data_1cqg_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 1cqg _Structure_validation_residue.Date_analyzed 2016-10-06 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.497 1.922 0 N-CA-C 109.296 -0.631 . . . . 2.18 109.296 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -94.64 123.22 37.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.4 108.748 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.9 mm -99.87 116.47 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.896 -1.15 . . . . 1.04 107.896 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.516 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 55.1 mp0 -99.48 -1.08 39.36 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.34 -0.85 . . . . 2.25 109.274 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.454 ' HG ' ' H ' ' A' ' 10' ' ' ALA . 80.0 p -155.74 156.49 34.94 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.988 -1.07 . . . . 0.91 111.481 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -63.34 -31.45 72.61 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.332 -0.988 . . . . 2.18 108.332 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 87.1 m -59.51 -47.52 85.22 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.729 -0.841 . . . . 1.03 108.729 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.454 ' H ' ' HG ' ' A' ' 7' ' ' SER . . . -67.97 -30.5 69.8 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.381 -0.825 . . . . 1.02 108.909 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -59.81 -41.42 91.21 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.378 -0.826 . . . . 0.15 109.276 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -66.78 -41.88 86.97 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.769 -0.826 . . . . 2.07 108.769 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.27 -40.45 93.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.825 -0.547 . . . . 1.77 110.686 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.27 87.38 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.244 -0.91 . . . . 1.04 109.278 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.8 mt -61.71 -39.95 93.33 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.868 -1.145 . . . . 1.07 108.574 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.99 -35.32 74.32 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.641 -0.662 . . . . 1.07 109.945 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.1 -36.48 79.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.24 -0.912 . . . . 1.07 109.901 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.4 -33.06 74.72 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 1.03 109.455 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.92 -127.28 24.82 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 109.583 -1.407 . . . . 0.24 109.583 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.493 ' CG ' ' HZ2' ' A' ' 82' ' ' LYS . 69.2 m-20 -90.02 2.17 55.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.258 . . . . 1.07 110.456 -178.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -75.22 150.09 38.72 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.906 -1.121 . . . . 2.03 110.171 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.437 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.6 155.21 15.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 107.395 -1.335 . . . . 1.23 107.395 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.437 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 89.5 t -142.38 110.43 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.187 -0.946 . . . . 1.03 108.954 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.1 t -97.37 142.58 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 N-CA-C 108.28 -1.007 . . . . 1.03 108.28 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.1 t -124.48 124.61 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.191 -0.943 . . . . 1.01 109.49 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.531 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -101.97 118.17 36.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.488 -0.757 . . . . 1.05 109.963 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.487 ' CE2' ' NE2' ' A' ' 78' ' ' GLN . 67.0 m-85 -95.8 21.63 8.28 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.288 -0.882 . . . . 0.73 109.531 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -57.5 148.59 23.3 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.926 -1.109 . . . . 0.84 110.697 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.04 123.93 32.66 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.054 -1.091 . . . . 1.04 108.054 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.6 t -67.94 -31.38 71.1 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.783 -1.167 . . . . 1.08 108.303 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.492 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 53.9 p-90 -71.05 -24.27 62.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.578 -0.701 . . . . 0.29 110.645 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -85.18 119.31 25.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.942 -1.098 . . . . 0.26 108.101 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.438 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.31 -53.22 47.37 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 111.134 -0.786 . . . . 0.28 111.134 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.6 Cg_exo -53.05 -37.16 78.68 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 CA-C-N 118.515 1.158 . . . . 0.5 112.344 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.6 6.63 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.487 -0.758 . . . . 1.04 110.083 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.84 -36.74 77.46 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.01 -1.056 . . . . 2.12 109.813 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.513 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.11 -29.73 67.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -0.798 . . . . 2.66 110.244 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 52.3 mt -83.89 0.45 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.439 -0.788 . . . . 1.22 110.999 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.566 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 12.9 ptmt -68.03 -28.52 1.89 Allowed Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 120.57 -1.331 . . . . 1.44 113.406 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.566 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.3 Cg_exo -53.03 -39.61 79.06 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 CA-C-N 121.857 1.699 . . . . 0.31 112.92 -176.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -69.13 -45.17 70.78 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 118.438 -1.305 . . . . 0.45 108.735 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -60.21 -52.97 63.05 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.132 -0.98 . . . . 0.16 109.694 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -68.71 -44.25 74.28 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.623 -0.673 . . . . 0.35 110.726 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.483 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 54.4 m -60.64 -39.7 89.26 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.059 -1.026 . . . . 0.77 111.186 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -64.53 -19.65 65.73 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.963 -1.086 . . . . 1.07 110.945 -177.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -49.87 -39.84 40.68 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.902 -1.124 . . . . 0.87 108.66 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -84.53 -13.82 50.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.69 -1.257 . . . . 2.16 109.485 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -76.44 -36.29 58.04 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.613 -1.254 . . . . 2.29 107.613 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -125.85 68.88 1.18 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.023 -1.473 . . . . 0.95 107.023 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -64.28 -7.95 11.16 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.509 -0.745 . . . . 0.89 109.113 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -91.48 8.99 33.74 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.898 -1.149 . . . . 1.13 107.898 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 38.8 t -128.0 141.82 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 107.875 -1.157 . . . . 1.06 107.875 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.426 HG22 HD11 ' A' ' 53' ' ' ILE . 25.8 mm -99.62 121.55 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.189 -0.945 . . . . 1.04 109.708 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -101.19 127.51 47.72 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.272 -0.893 . . . . 0.13 109.869 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.467 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.1 mp -109.89 141.03 43.18 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.306 -0.871 . . . . 1.08 108.812 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -109.51 131.24 55.25 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 106.677 -1.601 . . . . 1.13 106.677 177.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -128.67 131.99 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.438 -0.789 . . . . 1.03 110.638 -177.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.418 ' O ' ' N ' ' A' ' 62' ' ' ALA . 40.2 t0 -96.01 120.12 35.73 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.828 -0.804 . . . . 1.05 108.828 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.5 m -67.89 -19.03 24.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 O-C-N 120.456 -1.402 . . . . 1.04 108.513 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.492 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 12.0 m-20 -92.58 -44.22 8.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.377 -0.827 . . . . 1.08 111.529 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -94.23 -15.16 24.81 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.757 -1.214 . . . . 1.07 108.259 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.88 4.09 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.023 -1.102 . . . . 1.03 108.023 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -60.09 -26.54 66.28 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.59 -0.694 . . . . 1.92 110.35 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.1 -37.91 89.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.785 -1.197 . . . . 1.05 108.952 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.51 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 4.4 t -70.31 -44.24 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 121.275 -0.891 . . . . 1.1 109.249 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.8 -40.31 76.03 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.763 -0.586 . . . . 1.03 110.341 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.7 p -61.14 -33.59 73.64 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.199 -0.938 . . . . 0.89 109.222 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -60.36 -39.58 87.69 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.254 -0.904 . . . . 2.06 108.791 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . 0.428 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -89.82 -1.49 58.0 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.349 -0.844 . . . . 1.05 110.913 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 55.68 49.92 15.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.183 -0.948 . . . . 2.02 109.605 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.7 t -61.52 128.9 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 120.663 -1.273 . . . . 1.05 109.021 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -101.34 -10.91 19.85 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.712 -0.618 . . . . 2.16 110.045 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.61 155.99 17.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.689 -1.257 . . . . 1.04 110.459 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.9 p -129.22 154.05 80.51 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.075 -1.083 . . . . 1.04 108.075 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -75.53 141.65 71.79 Favored 'Cis proline' 0 N--CA 1.495 1.595 0 C-N-CA 123.862 -1.307 . . . . 0.19 113.148 -1.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.75 131.61 47.87 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.544 -0.91 . . . . 1.04 108.544 178.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.531 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.6 m-85 -108.82 130.65 55.4 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 109.001 -0.74 . . . . 0.23 109.001 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.487 ' NE2' ' CE2' ' A' ' 27' ' ' PHE . 70.9 mt-30 -122.81 140.48 52.88 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.247 -0.908 . . . . 0.43 108.601 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -107.78 136.03 48.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.762 -0.586 . . . . 0.17 110.228 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -127.1 149.22 50.04 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.023 -0.732 . . . . 0.17 109.023 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -145.77 120.48 9.85 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.772 -1.196 . . . . 2.18 107.772 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.493 ' HZ2' ' CG ' ' A' ' 20' ' ' ASP . 52.8 mttm 59.38 30.73 20.48 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.629 -1.248 . . . . 1.8 107.629 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.21 15.79 81.17 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.654 -1.378 . . . . 0.23 109.654 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -114.53 131.64 56.59 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.461 -1.023 . . . . 2.75 110.574 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -77.93 120.13 22.36 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.211 -0.93 . . . . 2.3 108.913 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.9 m -122.85 12.45 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.512 -0.742 . . . . 1.06 111.025 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.82 151.17 9.36 Favored Glycine 0 N--CA 1.49 2.297 0 C-N-CA 118.445 -1.836 . . . . 0.22 110.992 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.5 tm-20 -164.34 149.57 10.24 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.833 -0.804 . . . . 1.93 109.207 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 13.1 p90 -164.04 160.14 21.4 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.063 -1.055 . . . . 0.16 109.338 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.24 161.72 27.08 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.49 0.662 . . . . 0.9 109.749 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.98 141.04 5.82 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.542 -1.423 . . . . 0.12 109.542 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.06 66.4 2.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 1.04 109.903 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.11 94.21 4.31 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.51 -0.744 . . . . 1.36 109.51 178.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -31.64 72.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.062 -1.024 . . . . 1.6 111.539 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.99 -30.37 70.91 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.612 -1.305 . . . . 1.61 109.806 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -59.92 -34.33 73.06 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.627 0.727 . . . . 2.02 109.837 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.59 -39.09 83.01 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 122.046 0.927 . . . . 1.05 108.693 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.42 -44.19 97.04 Favored 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 120.111 -0.636 . . . . 2.1 110.4 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.57 -43.29 69.74 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.22 -0.925 . . . . 1.06 111.365 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.56 -40.37 95.45 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.978 -1.076 . . . . 1.04 108.939 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.6 mt -61.29 -46.08 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 106.843 -1.54 . . . . 1.04 106.843 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -60.48 -35.82 76.82 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.748 -0.834 . . . . 1.09 108.748 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -68.57 -39.95 80.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.547 -0.721 . . . . 2.21 110.111 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 80.2 mt -98.96 -0.09 42.88 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.107 -0.995 . . . . 1.05 111.624 -178.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.619 -1.3 . . . . 1.08 109.682 -179.51 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.509 -0.552 . . . . 1.89 109.509 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 29.9 mm -128.99 141.19 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.737 -0.602 . . . . 1.03 109.844 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.4 m -100.48 128.47 46.53 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.616 -1.624 . . . . 0.19 106.616 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -82.37 143.01 31.53 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.72 -1.238 . . . . 0.93 111.724 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -76.25 -13.31 60.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.565 -0.709 . . . . 0.21 109.33 179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 107.865 -1.161 . . . . 0.49 107.865 179.852 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.1 tttp . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 109.476 -0.564 . . . . 2.18 109.476 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -95.27 124.73 39.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.242 -0.911 . . . . 0.4 109.301 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mm -101.47 116.39 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.288 -1.004 . . . . 1.04 108.288 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -98.55 -3.54 36.16 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.009 -1.057 . . . . 2.25 109.721 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -152.26 159.93 43.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.863 -1.148 . . . . 0.91 110.975 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -63.98 -34.33 77.75 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.83 -1.174 . . . . 2.18 107.83 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -56.61 -46.22 81.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.49 -0.929 . . . . 1.03 108.49 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.56 -31.0 68.92 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.652 -0.87 . . . . 1.02 108.652 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -60.03 -43.3 95.4 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.105 -0.997 . . . . 0.15 108.936 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -66.56 -43.19 85.72 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.915 -0.772 . . . . 2.07 108.915 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -62.49 -40.72 97.59 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.583 -0.698 . . . . 1.77 110.622 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.11 -40.33 86.84 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.85 -1.157 . . . . 1.04 108.684 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.8 mt -60.76 -40.86 94.03 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 1.07 108.203 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -70.08 -34.5 73.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.318 -0.864 . . . . 1.07 109.592 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.8 75.18 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.643 -0.661 . . . . 1.07 110.202 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.09 71.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.185 -0.947 . . . . 1.03 109.71 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.78 -127.57 25.51 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 110.455 -1.058 . . . . 0.24 110.455 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -90.79 2.42 56.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.918 -1.342 . . . . 1.07 110.307 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.5 mttt -74.05 150.69 40.47 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.005 -1.059 . . . . 2.03 110.011 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.462 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.29 156.45 15.57 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.287 -1.375 . . . . 1.23 107.287 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.462 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 65.6 t -143.97 111.54 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.75 -1.219 . . . . 1.03 109.483 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.4 t -100.69 141.47 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 108.046 -1.094 . . . . 1.03 108.046 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.9 t -124.64 121.51 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.307 -0.871 . . . . 1.01 109.622 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -98.71 121.13 40.26 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.307 -0.871 . . . . 1.05 109.917 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.24 19.69 11.51 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.963 -1.086 . . . . 0.73 110.129 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.2 m -54.3 143.29 23.7 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.047 -1.033 . . . . 0.84 110.595 -178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.0 129.43 34.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.031 -1.1 . . . . 1.04 108.031 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -68.62 -32.29 72.06 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.987 -1.07 . . . . 1.08 108.997 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.509 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 54.4 p-90 -73.59 -21.54 60.3 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.598 -0.841 . . . . 0.29 110.803 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.8 t -84.66 113.14 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.099 -1.001 . . . . 0.26 108.594 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.435 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.26 -51.99 55.41 Favored Glycine 0 N--CA 1.486 2.007 0 C-N-CA 120.698 -0.763 . . . . 0.28 111.334 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 33.0 Cg_exo -50.31 -36.31 46.89 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 CA-C-N 119.002 1.401 . . . . 0.5 112.056 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.88 -46.19 19.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.39 -0.818 . . . . 1.04 109.148 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -59.28 -32.9 70.46 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.08 -1.013 . . . . 2.12 109.003 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.467 ' O ' ' SD ' ' A' ' 37' ' ' MET . 12.1 tmm? -59.15 -27.75 65.94 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.635 -0.666 . . . . 2.66 110.133 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.8 mt -83.58 -5.9 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.492 -0.755 . . . . 1.22 110.952 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.545 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.15 -31.56 9.56 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 119.62 -1.925 . . . . 1.44 113.32 -176.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.6 Cg_exo -59.68 -40.2 66.87 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 CA-C-N 121.347 1.517 . . . . 0.31 112.129 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.77 -1.172 . . . . 0.45 109.481 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -61.15 -50.63 72.42 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.229 -0.919 . . . . 0.16 109.317 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -67.99 -41.7 81.88 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-O 121.156 0.503 . . . . 0.35 110.974 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.2 m -64.72 -37.76 88.69 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.051 -1.031 . . . . 0.77 110.392 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.54 -23.67 67.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.444 -0.785 . . . . 1.07 110.62 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.9 m -53.14 -39.88 63.83 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.724 -1.235 . . . . 0.87 108.064 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -82.9 -17.77 42.54 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.421 -0.8 . . . . 2.16 109.292 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -75.65 -37.3 59.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.95 -1.5 . . . . 2.29 106.95 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -122.03 68.48 0.93 Allowed 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.977 -1.49 . . . . 0.95 106.977 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -63.59 -11.05 21.64 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.815 -0.809 . . . . 0.89 108.815 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -89.97 8.77 30.72 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.414 -0.958 . . . . 1.13 108.414 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 45.6 t -127.56 146.09 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.355 -0.98 . . . . 1.06 108.355 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -99.96 122.31 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.033 -1.042 . . . . 1.04 109.451 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -103.73 127.95 51.15 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.272 -0.892 . . . . 0.13 109.164 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.464 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 3.8 mp -111.35 139.95 46.34 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.249 -0.907 . . . . 1.08 109.153 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -111.87 129.89 56.01 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 106.828 -1.545 . . . . 1.13 106.828 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.1 t -127.25 139.12 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.608 -0.682 . . . . 1.03 110.851 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.409 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 56.8 t0 -99.22 118.38 35.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.598 -0.89 . . . . 1.05 108.598 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.05 -18.41 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 120.257 -1.527 . . . . 1.04 108.608 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.509 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.8 m-20 -92.27 -43.11 9.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.494 -0.754 . . . . 1.08 111.566 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.2 m-20 -95.66 -16.66 21.88 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.719 -1.238 . . . . 1.07 108.701 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.1 37.78 4.29 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.632 -1.247 . . . . 1.03 107.632 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -59.93 -20.48 57.66 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 1.92 110.154 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -66.97 -36.77 82.94 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.969 -1.082 . . . . 1.05 108.464 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.51 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.9 t -72.45 -45.65 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.424 -0.798 . . . . 1.1 109.742 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.87 -36.65 70.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.542 -0.724 . . . . 1.03 111.328 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.1 p -60.47 -37.02 79.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.212 . . . . 0.89 109.184 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.6 -35.48 80.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.495 -0.753 . . . . 2.06 109.369 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.27 -1.29 57.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.383 -0.823 . . . . 1.05 110.772 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mp0 54.87 49.87 16.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.215 -0.928 . . . . 2.02 109.846 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.51 135.88 27.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 120.915 -1.116 . . . . 1.05 108.562 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -107.41 -15.46 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.71 -0.619 . . . . 2.16 109.836 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.5 154.49 22.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.897 -1.127 . . . . 1.04 111.333 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -124.52 155.7 68.71 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 107.954 -1.128 . . . . 1.04 107.954 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -77.22 141.39 68.53 Favored 'Cis proline' 0 N--CA 1.495 1.567 0 C-N-CA 123.769 -1.346 . . . . 0.19 113.025 -2.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.2 m -125.87 130.73 51.92 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.644 -0.872 . . . . 1.04 108.644 177.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -108.77 131.44 54.95 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.759 -0.83 . . . . 0.23 108.759 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -122.97 143.48 49.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.35 -0.982 . . . . 0.43 108.35 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -109.71 134.11 52.37 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.334 0.588 . . . . 0.17 110.594 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -126.83 148.76 49.95 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.406 -0.59 . . . . 0.17 109.406 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -147.2 127.61 14.02 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.926 -1.138 . . . . 2.18 107.926 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 53.48 33.58 16.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.91 -1.119 . . . . 1.8 108.296 -178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.49 20.17 79.65 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.201 -1.16 . . . . 0.23 110.201 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -124.07 134.06 53.48 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.351 -1.088 . . . . 2.75 111.088 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -77.9 126.17 30.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.418 -0.801 . . . . 2.3 109.25 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.7 m -124.12 4.35 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.637 -0.664 . . . . 1.06 111.038 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.67 160.63 25.97 Favored Glycine 0 N--CA 1.496 2.669 0 C-N-CA 118.14 -1.981 . . . . 0.22 111.581 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -168.56 148.02 4.41 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 122.088 -0.654 . . . . 1.93 109.882 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -162.06 160.1 27.06 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.277 -0.889 . . . . 0.16 109.118 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -126.1 160.82 29.11 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.486 0.66 . . . . 0.9 109.991 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.36 143.28 6.44 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.014 -1.635 . . . . 0.12 109.014 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.4 65.71 3.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.044 -1.268 . . . . 1.04 109.877 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.06 97.07 5.62 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.622 -0.881 . . . . 1.36 108.622 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.44 -33.53 73.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.489 -0.757 . . . . 1.6 111.384 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.86 -29.97 71.1 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 1.61 109.239 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -60.53 -36.93 79.6 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-O 121.439 0.638 . . . . 2.02 109.51 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 53.9 mt -57.82 -39.75 78.38 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 122.084 0.945 . . . . 1.05 108.499 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -60.98 -43.43 98.82 Favored 'General case' 0 C--N 1.289 -2.047 0 C-N-CA 119.904 -0.718 . . . . 2.1 110.879 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.28 -43.86 76.81 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.206 -0.934 . . . . 1.06 111.507 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.5 m -65.3 -40.3 93.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.709 -1.244 . . . . 1.04 109.706 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.95 -49.58 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 N-CA-C 108.196 -1.039 . . . . 1.04 108.196 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -60.29 -36.04 76.94 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.923 0.868 . . . . 1.09 108.678 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -67.44 -39.98 85.42 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.808 -0.558 . . . . 2.21 110.091 -178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.7 mt -100.88 2.61 41.09 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.299 -0.875 . . . . 1.05 111.17 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.423 -1.423 . . . . 1.08 109.263 -179.609 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.67 0.271 . . . . 1.89 110.407 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 31.5 mm -129.91 139.91 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.672 -0.643 . . . . 1.03 109.424 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.0 m -101.03 132.05 46.63 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 106.88 -1.526 . . . . 0.19 106.88 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m -83.93 140.01 32.22 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.603 -1.311 . . . . 0.93 111.219 -177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 20.6 m95 -73.15 -8.65 56.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.223 -0.923 . . . . 0.21 109.921 179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 120.949 -1.095 . . . . 0.49 108.917 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.6 tptt . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 108.796 -0.816 . . . . 2.18 108.796 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -98.72 124.1 43.35 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 0.4 108.884 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -102.8 115.08 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 108.666 -0.864 . . . . 1.04 108.666 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -97.79 -0.05 45.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.16 -0.962 . . . . 2.25 110.173 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.12 154.22 34.36 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.869 -1.144 . . . . 0.91 111.01 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -63.64 -32.39 73.85 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.175 -1.046 . . . . 2.18 108.175 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 47.6 m -57.24 -48.43 78.85 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.179 -1.008 . . . . 1.03 108.596 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.75 -31.01 69.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.36 -0.837 . . . . 1.02 109.163 178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -59.45 -44.03 93.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.159 -0.963 . . . . 0.15 109.006 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -65.56 -40.88 93.33 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.705 -0.85 . . . . 2.07 108.705 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.34 -37.12 86.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.555 -0.716 . . . . 1.77 110.327 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.76 -42.34 81.91 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.327 -0.858 . . . . 1.04 109.054 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.73 -40.35 92.04 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.609 -0.885 . . . . 1.07 108.609 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -70.04 -38.5 75.85 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.632 -0.667 . . . . 1.07 110.275 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.3 -37.38 80.58 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.254 -0.904 . . . . 1.07 109.988 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.85 69.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.204 -0.935 . . . . 1.03 109.303 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.03 -127.28 30.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.931 -1.268 . . . . 0.24 109.931 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -89.92 1.34 56.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.263 -1.139 . . . . 1.07 110.689 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttt -73.34 150.0 42.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.788 -1.195 . . . . 2.03 109.493 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.463 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.48 156.29 16.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 107.472 -1.307 . . . . 1.23 107.472 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.463 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 84.4 t -143.34 111.33 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.132 -0.98 . . . . 1.03 108.992 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.89 140.57 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.135 -1.061 . . . . 1.03 108.135 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.53 123.96 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.325 -0.859 . . . . 1.01 109.249 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.523 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 27.4 t70 -102.32 118.43 36.87 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.465 -0.772 . . . . 1.05 109.692 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -95.42 23.15 6.18 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.197 -0.939 . . . . 0.73 109.974 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.1 m -59.13 145.7 41.47 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.742 -1.224 . . . . 0.84 110.078 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.74 126.87 32.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 107.957 -1.127 . . . . 1.04 107.957 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 t -68.08 -30.14 69.25 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.263 -1.014 . . . . 1.08 108.263 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.564 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 67.1 p-90 -76.44 -15.03 60.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.488 -0.757 . . . . 0.29 110.624 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.16 121.05 28.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.809 -1.182 . . . . 0.26 108.378 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.44 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -64.66 -53.62 33.83 Favored Glycine 0 N--CA 1.495 2.58 0 O-C-N 121.542 -0.724 . . . . 0.28 112.698 -177.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.44 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.5 Cg_endo -61.11 -29.92 88.16 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 CA-C-N 119.349 1.575 . . . . 0.5 112.279 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.22 17.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.155 -0.966 . . . . 1.04 109.442 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -59.75 -30.84 69.13 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.067 -1.021 . . . . 2.12 109.111 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.508 ' O ' ' SD ' ' A' ' 37' ' ' MET . 13.8 tmm? -59.69 -28.4 67.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.643 -0.661 . . . . 2.66 109.498 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.6 mt -81.48 -4.13 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 O-C-N 121.545 -0.722 . . . . 1.22 111.179 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.21 -31.95 10.49 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 119.982 -1.699 . . . . 1.44 113.528 -177.063 . . . . . . . . 3 3 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.9 Cg_exo -59.09 -39.84 75.99 Favored 'Trans proline' 0 N--CA 1.494 1.529 0 CA-C-N 121.387 1.531 . . . . 0.31 113.244 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -69.12 -49.22 59.03 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.504 -1.372 . . . . 0.45 108.849 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -59.99 -51.22 70.57 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.728 -0.842 . . . . 0.16 108.728 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 46.3 t60 -66.11 -44.14 85.16 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.897 -0.502 . . . . 0.35 110.985 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.5 m -63.24 -39.98 96.13 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.828 -1.17 . . . . 0.77 110.722 -179.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.02 -23.9 65.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.194 -0.941 . . . . 1.07 110.596 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -52.14 -40.19 61.01 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.84 -1.163 . . . . 0.87 108.602 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -84.66 -15.33 45.75 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.316 -0.865 . . . . 2.16 109.569 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -76.97 -38.08 53.95 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 107.502 -1.296 . . . . 2.29 107.502 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -121.64 68.0 0.91 Allowed 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 106.671 -1.603 . . . . 0.95 106.671 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 p -63.22 -9.88 13.18 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.384 -0.969 . . . . 0.89 108.384 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -90.23 9.75 27.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.129 -1.063 . . . . 1.13 108.129 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.3 t -127.85 143.94 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.861 -1.163 . . . . 1.06 107.861 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.6 mm -99.95 120.58 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 120.994 -1.066 . . . . 1.04 109.483 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -103.3 126.06 50.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.181 -0.949 . . . . 0.13 109.816 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.477 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.2 mp -110.09 144.49 38.62 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.257 -0.902 . . . . 1.08 110.045 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -112.97 131.48 55.73 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.24 -1.393 . . . . 1.13 107.24 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.5 t -129.5 132.81 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.277 -0.89 . . . . 1.03 110.409 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.409 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 51.7 t0 -94.58 120.05 34.21 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.376 -0.827 . . . . 1.05 109.308 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.6 m -66.55 -18.17 23.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.478 -1.389 . . . . 1.04 108.156 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 16.1 m-20 -93.29 -44.79 8.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.441 -0.787 . . . . 1.08 112.264 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 78.9 m-20 -94.83 -13.61 25.38 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.554 -1.341 . . . . 1.07 108.91 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.4 37.88 4.31 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.542 -1.281 . . . . 1.03 107.542 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -60.12 -20.9 60.55 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.772 -0.58 . . . . 1.92 109.496 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.1 p30 -62.64 -36.96 84.51 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.929 -1.107 . . . . 1.05 108.473 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.524 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 21.4 t -73.31 -42.11 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.299 -0.876 . . . . 1.1 109.112 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.7 -41.43 79.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.392 -0.818 . . . . 1.03 111.083 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -59.99 -37.94 81.13 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.983 -1.073 . . . . 0.89 109.666 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -66.61 -37.93 85.92 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 2.06 109.507 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.56 -3.73 58.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.159 -0.963 . . . . 1.05 110.948 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 54.05 49.88 17.87 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.984 -1.073 . . . . 2.02 110.541 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.85 131.69 30.64 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.723 -1.236 . . . . 1.05 108.999 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -102.45 -10.73 19.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.572 -0.705 . . . . 2.16 110.655 -179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.477 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.97 154.27 17.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.607 -1.308 . . . . 1.04 111.136 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.4 p -127.36 154.12 77.17 Favored Pre-proline 0 N--CA 1.502 2.147 0 N-CA-C 107.585 -1.265 . . . . 1.04 107.585 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -75.97 141.64 71.25 Favored 'Cis proline' 0 N--CA 1.497 1.718 0 C-N-CA 124.172 -1.179 . . . . 0.19 113.006 -1.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 91.5 m -126.98 132.29 50.84 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 121.657 0.742 . . . . 1.04 109.26 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.523 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.2 m-85 -109.0 130.24 55.47 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.779 -0.823 . . . . 0.23 108.779 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -122.16 140.35 52.67 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.615 -0.883 . . . . 0.43 108.615 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -107.9 134.86 50.22 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.398 0.618 . . . . 0.17 110.186 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -129.19 146.04 51.2 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.288 0.566 . . . . 0.17 109.56 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -145.46 134.89 23.13 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 107.283 -1.376 . . . . 2.18 107.283 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.8 mttt 50.06 33.36 6.81 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.923 -1.11 . . . . 1.8 109.014 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.98 25.68 74.22 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.58 -1.408 . . . . 0.23 109.58 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -129.14 132.78 47.4 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.465 -1.02 . . . . 2.75 110.989 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.1 122.89 26.8 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.083 -0.71 . . . . 2.3 109.083 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.0 m -123.35 8.33 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.698 . . . . 1.06 110.433 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.44 153.86 14.35 Favored Glycine 0 N--CA 1.495 2.578 0 C-N-CA 118.344 -1.884 . . . . 0.22 111.82 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -166.05 149.11 7.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 122.033 -0.686 . . . . 1.93 109.56 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.497 ' CB ' ' HZ3' ' A' ' 96' ' ' LYS . 19.9 p90 -163.66 163.66 24.22 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.279 -0.968 . . . . 0.16 109.339 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.91 160.34 31.3 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.504 0.669 . . . . 0.9 110.191 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.2 141.69 5.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.594 -1.402 . . . . 0.12 109.594 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.27 65.41 2.85 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.288 -1.125 . . . . 1.04 109.347 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.55 93.95 4.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.587 -0.894 . . . . 1.36 108.587 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.47 74.65 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.273 -0.892 . . . . 1.6 111.494 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.84 -29.79 70.95 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.758 -1.214 . . . . 1.61 109.307 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.497 ' HZ3' ' CB ' ' A' ' 89' ' ' PHE . 56.5 tttm -61.11 -34.75 75.46 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.558 -0.714 . . . . 2.02 109.215 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 38.6 mt -58.92 -38.91 80.03 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.967 -1.123 . . . . 1.05 107.967 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -61.93 -42.54 99.21 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.906 -0.718 . . . . 2.1 110.966 -178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.75 -43.8 75.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.003 -1.061 . . . . 1.06 111.717 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.4 m -65.65 -39.63 91.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.694 -1.254 . . . . 1.04 110.055 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -60.92 -49.15 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.921 -1.112 . . . . 1.04 108.73 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -60.5 -35.52 76.13 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.151 -1.055 . . . . 1.09 108.151 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -67.45 -39.94 85.39 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 115.973 -0.558 . . . . 2.21 110.143 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.6 mt -99.23 -1.46 39.12 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.172 -0.955 . . . . 1.05 111.344 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.498 1.97 0 O-C-N 120.49 -1.381 . . . . 1.08 109.426 -179.631 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.459 -0.571 . . . . 1.89 109.459 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 33.6 mm -129.56 140.0 50.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.843 -0.535 . . . . 1.03 109.732 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -98.06 127.33 43.94 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 106.525 -1.658 . . . . 0.19 106.525 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.0 m -80.79 145.2 31.58 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.833 -1.167 . . . . 0.93 110.755 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.465 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.0 m95 -77.39 -9.94 59.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.133 -0.979 . . . . 0.21 108.815 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.355 -0.841 . . . . 0.49 108.762 179.73 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.3 tptt . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 108.345 -0.983 . . . . 2.18 108.345 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.532 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 65.4 tt0 -96.75 124.26 40.68 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.421 -0.799 . . . . 0.4 108.944 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.8 mm -102.65 117.1 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 108.505 -0.924 . . . . 1.04 108.505 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.532 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 64.4 mm-40 -99.72 -2.51 35.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.289 -0.882 . . . . 2.25 109.888 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -155.15 157.27 37.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.185 -0.947 . . . . 0.91 111.115 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.191 -1.04 . . . . 2.18 108.191 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.4 m -55.84 -48.4 75.57 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.354 -0.938 . . . . 1.03 109.191 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.72 -30.33 67.93 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.254 -0.904 . . . . 1.02 109.218 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.88 -44.26 91.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.326 -0.859 . . . . 0.15 109.38 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -64.81 -42.31 95.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.308 -0.87 . . . . 2.07 109.151 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.534 ' OE1' ' N ' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.55 -39.58 94.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.753 -0.592 . . . . 1.77 110.451 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.99 -41.1 87.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.234 -0.917 . . . . 1.04 109.12 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.58 -40.42 91.67 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 108.11 -1.07 . . . . 1.07 108.11 179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -69.09 -35.99 77.09 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.353 0.597 . . . . 1.07 110.416 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.4 79.58 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.271 -0.893 . . . . 1.07 109.541 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.15 -34.6 73.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.363 -0.836 . . . . 1.03 109.799 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.21 -125.65 21.66 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 110.019 -1.232 . . . . 0.24 110.019 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -90.86 2.41 56.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.237 -1.155 . . . . 1.07 110.462 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -73.83 151.83 40.42 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.93 -1.106 . . . . 2.03 109.622 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.498 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.52 158.16 18.65 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 106.811 -1.552 . . . . 1.23 106.811 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.498 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 57.8 t -145.62 123.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.987 -1.07 . . . . 1.03 108.743 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -112.2 140.25 32.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 108.483 -0.932 . . . . 1.03 108.483 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.7 t -123.44 119.99 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.358 -0.838 . . . . 1.01 109.499 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -97.42 119.75 36.54 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.306 -0.871 . . . . 1.05 110.038 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -96.52 25.26 5.21 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.955 -1.091 . . . . 0.73 110.175 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.4 m -59.89 147.33 38.91 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 120.954 -1.091 . . . . 0.84 110.773 -178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.48 126.53 32.87 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.772 -1.196 . . . . 1.04 107.772 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.5 -33.97 76.19 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.024 -1.102 . . . . 1.08 108.024 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.525 ' CD1' ' OD1' ' A' ' 60' ' ' ASP . 59.7 p-90 -71.35 -26.63 62.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.447 -0.783 . . . . 0.29 110.686 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.6 t -80.7 112.9 18.51 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.834 -1.172 . . . . 0.26 107.834 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.463 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.36 -51.22 60.09 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 111.274 -0.73 . . . . 0.28 111.274 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -49.84 -37.87 46.41 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.754 1.277 . . . . 0.5 111.318 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.37 -46.98 29.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.191 -0.943 . . . . 1.04 108.913 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -59.74 -30.15 68.64 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.626 -0.879 . . . . 2.12 108.626 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 12.4 tpt -59.67 -30.19 68.58 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.601 -0.687 . . . . 2.66 110.14 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.3 mt -83.58 -4.79 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.695 -0.628 . . . . 1.22 110.756 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.548 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.54 -31.94 10.21 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.803 -1.81 . . . . 1.44 113.236 -176.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -57.91 -38.96 90.35 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 CA-C-N 121.487 1.567 . . . . 0.31 111.914 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -71.79 -51.23 23.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.146 -0.971 . . . . 0.45 108.985 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.44 -48.04 82.01 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.16 -0.962 . . . . 0.16 108.613 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -68.62 -41.24 79.77 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.567 -0.708 . . . . 0.35 110.746 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 58.7 m -63.82 -37.21 86.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.997 -1.064 . . . . 0.77 109.952 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.1 mt -62.29 -27.82 69.29 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.108 -0.995 . . . . 1.07 110.649 -178.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.2 m -51.73 -38.02 53.5 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 120.873 -1.142 . . . . 0.87 109.03 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -87.02 -15.7 37.88 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.12 -0.987 . . . . 2.16 109.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -79.02 -37.94 37.82 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.625 -1.297 . . . . 2.29 107.709 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -120.32 65.93 0.83 Allowed 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 106.857 -1.534 . . . . 0.95 106.857 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.4 p -62.93 -8.11 6.51 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 108.625 -0.88 . . . . 0.89 108.625 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -91.02 4.44 52.08 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.957 -0.757 . . . . 1.13 108.957 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.0 t -124.29 147.84 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.078 -1.453 . . . . 1.06 107.078 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.17 123.5 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 120.956 -1.09 . . . . 1.04 109.248 -178.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -103.94 126.87 51.38 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.35 -0.844 . . . . 0.13 110.039 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.459 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.4 mp -111.98 141.76 45.23 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 121.281 -0.887 . . . . 1.08 109.518 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -111.82 132.27 54.79 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 107.313 -1.366 . . . . 1.13 107.313 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.88 135.68 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.268 -0.895 . . . . 1.03 110.486 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -98.48 120.61 39.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.444 -0.785 . . . . 1.05 109.121 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.21 -19.6 25.92 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 O-C-N 120.643 -1.286 . . . . 1.04 108.404 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.525 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.0 m-20 -93.05 -41.65 9.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.521 -0.737 . . . . 1.08 111.812 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -95.54 -16.66 22.01 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.645 -1.284 . . . . 1.07 108.659 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.71 39.06 4.05 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.777 -1.194 . . . . 1.03 107.777 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.11 -19.99 56.07 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.753 -0.592 . . . . 1.92 109.938 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -65.03 -36.55 84.74 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.073 -1.017 . . . . 1.05 108.877 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.539 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -72.73 -42.44 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 108.409 -0.96 . . . . 1.1 108.409 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.04 -40.66 82.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.608 -0.683 . . . . 1.03 110.568 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.6 p -60.23 -40.29 89.71 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.761 -1.175 . . . . 0.89 109.577 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -66.2 -39.38 89.61 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 2.06 109.175 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.52 -4.68 59.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.152 -0.968 . . . . 1.05 110.739 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 53.77 49.98 18.01 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.852 -1.155 . . . . 2.02 109.887 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.6 t -65.01 130.46 30.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 C-N-CA 118.425 -1.31 . . . . 1.05 108.375 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -103.05 -11.07 18.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.576 -0.702 . . . . 2.16 110.694 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.495 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.25 155.81 23.2 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.599 -1.313 . . . . 1.04 110.605 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.1 p -129.44 153.63 80.63 Favored Pre-proline 0 N--CA 1.501 2.1 0 N-CA-C 108.148 -1.056 . . . . 1.04 108.148 178.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -76.59 143.33 75.75 Favored 'Cis proline' 0 N--CA 1.489 1.259 0 C-N-CA 123.613 -1.411 . . . . 0.19 112.667 -2.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.3 m -127.85 135.0 49.44 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.23 -1.026 . . . . 1.04 108.23 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -113.32 131.84 55.8 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.966 -0.753 . . . . 0.23 108.966 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -120.44 141.86 49.76 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.283 -1.006 . . . . 0.43 108.283 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -108.03 134.8 50.42 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.472 0.653 . . . . 0.17 110.226 -179.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -128.64 147.11 50.71 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 109.176 -0.675 . . . . 0.17 109.176 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -149.62 125.29 10.39 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.788 -1.19 . . . . 2.18 107.788 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 59.74 30.2 19.78 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 107.787 -1.19 . . . . 1.8 107.787 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.1 14.91 81.8 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.713 -1.355 . . . . 0.23 109.713 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.42 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 4.4 mm-40 -116.89 135.64 53.56 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.546 -0.973 . . . . 2.75 110.91 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -78.98 123.88 27.72 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.695 -0.854 . . . . 2.3 108.695 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.2 m -123.8 7.61 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.472 -0.768 . . . . 1.06 111.439 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.95 156.13 17.22 Favored Glycine 0 N--CA 1.498 2.819 0 C-N-CA 118.426 -1.845 . . . . 0.22 111.513 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -164.71 149.17 9.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.872 -0.781 . . . . 1.93 109.353 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.447 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 7.0 p90 -163.86 159.44 21.09 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.635 -0.826 . . . . 0.16 109.78 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.6 p -127.37 160.65 30.76 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.595 0.712 . . . . 0.9 109.924 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.22 140.6 5.7 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.17 -1.572 . . . . 0.12 109.17 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.28 67.27 2.5 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.219 -1.165 . . . . 1.04 109.146 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.37 95.09 4.59 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.548 -0.908 . . . . 1.36 108.548 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -34.76 77.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.141 -0.975 . . . . 1.6 111.403 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.97 -28.71 70.27 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.077 -1.015 . . . . 1.61 109.412 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.84 -34.64 76.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.331 -0.856 . . . . 2.02 108.836 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.46 -38.69 81.44 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.218 -1.03 . . . . 1.05 108.218 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -63.16 -43.4 98.41 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 119.845 -0.742 . . . . 2.1 110.46 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -44.0 77.33 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 1.06 111.143 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.9 m -65.37 -39.67 92.6 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.973 -1.079 . . . . 1.04 110.706 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.01 -48.36 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.067 -1.02 . . . . 1.04 108.267 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -60.5 -34.75 74.52 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.194 -1.039 . . . . 1.09 108.194 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.9 tt0 -67.93 -39.89 83.44 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.548 -0.72 . . . . 2.21 110.63 -178.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -100.68 0.28 38.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.226 -0.922 . . . . 1.05 111.273 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 N--CA 1.497 1.905 0 O-C-N 120.569 -1.332 . . . . 1.08 108.992 -179.517 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 108.847 -0.797 . . . . 1.89 108.847 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 29.7 mm -126.34 139.97 50.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 109.372 -0.603 . . . . 1.03 109.372 179.871 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 5.0 m -96.45 127.98 42.96 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 106.54 -1.652 . . . . 0.19 106.54 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.3 m -78.89 144.25 35.09 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.852 -1.155 . . . . 0.93 110.554 -178.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.404 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.8 m95 -79.62 -14.62 58.68 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.21 109.056 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.0 m120 . . . . . 0 N--CA 1.487 1.419 0 N-CA-C 107.788 -1.19 . . . . 0.49 107.788 179.14 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 108.782 -0.821 . . . . 2.18 108.782 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -97.01 124.03 40.88 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.867 -0.79 . . . . 0.4 108.867 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.2 mm -102.15 115.83 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 108.17 -1.048 . . . . 1.04 108.17 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -99.68 0.14 41.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.333 -0.854 . . . . 2.25 109.619 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.2 155.15 37.21 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.146 -0.971 . . . . 0.91 110.929 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.534 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 4.3 ttpm? -65.26 -32.85 74.72 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.765 -1.198 . . . . 2.18 107.765 177.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.444 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 46.5 m -58.71 -46.98 86.12 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.215 -1.031 . . . . 1.03 108.215 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.24 -31.76 70.53 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.37 -0.831 . . . . 1.02 108.837 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -59.81 -43.71 94.37 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.15 109.15 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -64.45 -44.01 92.47 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.584 -0.847 . . . . 2.07 108.796 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.44 -41.1 98.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.565 -0.709 . . . . 1.77 110.723 179.301 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.76 -42.17 95.34 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.252 -0.905 . . . . 1.04 109.285 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.1 mt -59.85 -39.86 86.62 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.089 -1.007 . . . . 1.07 108.418 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.41 -34.67 74.81 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.592 -0.693 . . . . 1.07 110.476 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.02 80.9 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 1.07 110.591 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.21 -30.97 69.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.127 -0.983 . . . . 1.03 110.067 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.95 -125.7 25.42 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.171 -1.172 . . . . 0.24 110.171 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -90.7 3.49 54.1 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -1.143 . . . . 1.07 109.964 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -75.63 148.55 38.67 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 2.03 109.892 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.502 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.54 157.78 16.51 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.667 -1.234 . . . . 1.23 107.667 179.306 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.502 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 46.9 t -147.01 118.07 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 120.903 -1.123 . . . . 1.03 108.884 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 139.48 27.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.378 -0.971 . . . . 1.03 108.378 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.5 t -123.02 122.62 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.135 -0.978 . . . . 1.01 110.081 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -98.21 119.7 37.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.441 -0.787 . . . . 1.05 109.919 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -96.38 24.46 5.79 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.068 -1.02 . . . . 0.73 109.886 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.7 m -58.64 146.94 34.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.84 110.077 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.55 122.92 30.37 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.926 -1.139 . . . . 1.04 107.926 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 t -67.28 -30.26 70.08 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 118.962 -1.095 . . . . 1.08 108.088 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.564 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 52.1 p-90 -71.45 -27.0 62.96 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.441 -0.787 . . . . 0.29 110.885 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.6 t -83.79 120.49 26.1 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.109 -1.071 . . . . 0.26 108.109 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -62.37 -52.1 51.69 Favored Glycine 0 N--CA 1.489 2.2 0 C-N-CA 119.846 -1.169 . . . . 0.28 111.042 -178.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.4 Cg_exo -52.15 -34.58 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.702 1.251 . . . . 0.5 112.59 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.96 -53.77 7.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.91 . . . . 1.04 110.276 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -60.0 -37.37 79.48 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.803 -1.185 . . . . 2.12 109.701 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.525 ' O ' ' SD ' ' A' ' 37' ' ' MET . 12.0 tmm? -58.46 -27.98 64.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.148 -0.97 . . . . 2.66 109.342 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.4 mt -87.01 -12.07 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.599 -0.688 . . . . 1.22 112.051 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 29.6 pttt -67.44 -30.53 3.03 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 120.062 -1.649 . . . . 1.44 113.511 -177.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.8 Cg_exo -49.79 -36.78 43.43 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 121.803 1.68 . . . . 0.31 112.215 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -67.79 -44.13 78.09 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.384 -1.71 . . . . 0.45 106.384 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.35 -52.45 65.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.946 . . . . 0.16 110.101 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -67.62 -40.11 84.68 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.49 -0.757 . . . . 0.35 109.928 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 70.3 m -61.17 -39.58 90.7 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.381 -0.824 . . . . 0.77 110.567 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.2 mt -62.36 -19.58 63.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.45 -0.781 . . . . 1.07 110.707 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -55.4 -37.12 67.18 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.593 -1.317 . . . . 0.87 108.471 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -82.73 -19.8 37.22 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.509 -0.744 . . . . 2.16 109.103 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -76.62 -37.36 56.5 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.91 -1.144 . . . . 2.29 107.91 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -123.69 67.12 1.02 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.136 -1.431 . . . . 0.95 107.136 177.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 80.2 p -63.44 -10.05 15.47 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.42 0.629 . . . . 0.89 109.573 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -91.02 10.43 26.69 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.215 -1.031 . . . . 1.13 108.215 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 48.2 t -128.52 148.21 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 108.353 -0.98 . . . . 1.06 108.353 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.423 HD11 HG22 ' A' ' 53' ' ' ILE . 30.0 mm -98.79 123.95 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.129 -0.982 . . . . 1.04 109.688 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -108.43 123.86 49.52 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.354 -0.841 . . . . 0.13 109.246 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.428 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 4.9 mp -110.26 144.81 38.41 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 120.906 -1.121 . . . . 1.08 110.136 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -112.54 129.73 56.26 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 106.577 -1.638 . . . . 1.13 106.577 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.4 t -126.46 135.54 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.19 -0.944 . . . . 1.03 110.63 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.433 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 58.2 t0 -94.47 119.66 33.51 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.738 -0.838 . . . . 1.05 108.738 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.2 m -69.16 -18.52 22.85 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 C-N-CA 118.638 -1.225 . . . . 1.04 108.453 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.8 m-20 -93.01 -42.68 9.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.45 -0.781 . . . . 1.08 111.343 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.433 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 81.3 m-20 -93.92 -15.26 25.13 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.623 -1.298 . . . . 1.07 108.098 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.4 38.39 4.16 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 107.684 -1.228 . . . . 1.03 107.684 179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.8 pt20 -59.56 -22.63 61.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 1.92 109.8 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.534 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 4.8 p-10 -66.07 -42.9 88.81 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.104 -0.997 . . . . 1.05 108.766 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.72 -44.01 82.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 O-C-N 121.328 -0.858 . . . . 1.1 109.88 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.81 72.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.215 -0.928 . . . . 1.03 110.324 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.8 p -61.6 -31.66 71.74 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.045 -1.034 . . . . 0.89 108.711 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -63.81 -40.16 95.97 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.445 -0.785 . . . . 2.06 109.398 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.69 1.39 55.19 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.461 -0.774 . . . . 1.05 110.923 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 54.49 50.83 15.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.991 -1.068 . . . . 2.02 109.246 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.1 t -64.35 129.16 27.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 C-N-CA 118.261 -1.376 . . . . 1.05 107.939 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -101.71 -12.71 18.16 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.65 -0.656 . . . . 2.16 109.904 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.47 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.58 156.93 21.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.98 -1.075 . . . . 1.04 110.7 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -129.38 154.62 80.71 Favored Pre-proline 0 N--CA 1.501 2.103 0 N-CA-C 108.184 -1.043 . . . . 1.04 108.184 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -75.0 142.02 73.51 Favored 'Cis proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.841 -1.316 . . . . 0.19 113.439 -1.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -126.31 132.19 51.68 Favored 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.521 -0.918 . . . . 1.04 108.521 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -111.39 127.15 55.57 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.401 -0.962 . . . . 0.23 108.401 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -119.5 141.48 49.15 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.149 -0.969 . . . . 0.43 108.898 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.405 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 70.8 m-85 -107.8 132.21 53.64 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.198 0.523 . . . . 0.17 110.177 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -125.63 146.3 49.77 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.553 0.692 . . . . 0.17 109.499 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -146.69 129.78 16.46 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.622 -1.251 . . . . 2.18 107.622 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 53.34 31.99 12.89 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.108 -0.995 . . . . 1.8 109.76 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.36 19.78 77.83 Favored Glycine 0 N--CA 1.491 2.321 0 O-C-N 120.954 -1.091 . . . . 0.23 110.879 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -128.77 139.79 52.03 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.311 -1.111 . . . . 2.75 110.378 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -81.3 127.83 33.16 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.196 -0.94 . . . . 2.3 109.506 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.2 m -123.94 9.74 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.608 -0.683 . . . . 1.06 110.283 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.97 151.14 9.68 Favored Glycine 0 N--CA 1.5 2.952 0 C-N-CA 118.719 -1.705 . . . . 0.22 111.713 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -166.06 148.92 7.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.621 -0.929 . . . . 1.93 109.806 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -163.72 162.93 24.25 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.598 -0.841 . . . . 0.16 108.81 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.7 p -126.74 159.92 32.34 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.351 -0.611 . . . . 0.9 109.351 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.4 143.37 6.16 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.834 -1.306 . . . . 0.12 109.834 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.58 65.12 2.34 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.15 -1.206 . . . . 1.04 110.098 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.484 ' ND2' ' OE1' ' A' ' 95' ' ' GLU . 0.7 OUTLIER -119.46 94.0 4.27 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 107.936 -1.135 . . . . 1.36 107.936 178.334 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -33.15 73.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.079 -1.013 . . . . 1.6 111.303 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.484 ' OE1' ' ND2' ' A' ' 93' ' ' ASN . 35.1 mp0 -63.41 -30.18 71.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.943 -1.098 . . . . 1.61 109.291 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -60.73 -33.68 73.27 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.167 -0.679 . . . . 2.02 109.167 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 35.8 mt -59.76 -38.95 83.22 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.566 -0.902 . . . . 1.05 108.566 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -62.67 -40.93 98.62 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.095 -0.642 . . . . 2.1 110.992 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.39 -44.1 72.15 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.246 -0.909 . . . . 1.06 112.027 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.55 -38.62 91.64 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.724 -1.235 . . . . 1.04 110.025 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.13 -48.91 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 108.162 -1.051 . . . . 1.04 108.162 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -61.0 -34.12 74.32 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.561 -0.903 . . . . 1.09 108.561 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -68.85 -39.86 79.7 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.485 -0.759 . . . . 2.21 110.186 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.4 mt -100.72 1.45 40.45 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.376 -0.828 . . . . 1.05 111.345 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 N--CA 1.499 2.002 0 O-C-N 120.475 -1.391 . . . . 1.08 109.064 179.955 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.935 0.398 . . . . 1.89 109.953 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 29.1 mm -131.94 140.71 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 N-CA-C 109.716 -0.476 . . . . 1.03 109.716 -179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 56.4 m -98.63 131.68 44.63 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.817 -1.549 . . . . 0.19 106.817 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -81.18 144.85 31.33 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.629 -1.294 . . . . 0.93 111.372 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.407 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.2 m95 -79.62 -13.86 59.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.21 109.106 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 107.363 -1.347 . . . . 0.49 107.363 179.404 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptp . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 108.77 -0.826 . . . . 2.18 108.77 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -93.84 121.92 35.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.14 -0.975 . . . . 0.4 109.316 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.3 mm -101.51 117.53 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.492 -0.929 . . . . 1.04 108.492 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -99.1 -1.75 38.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.377 -0.827 . . . . 2.25 109.515 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.26 155.33 36.38 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.825 -1.172 . . . . 0.91 111.542 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.489 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 34.4 ttmt -63.61 -32.87 74.47 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.94 -1.133 . . . . 2.18 107.94 177.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 80.5 m -58.71 -45.89 88.57 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.153 -1.019 . . . . 1.03 108.316 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.86 -31.82 69.86 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.304 -0.873 . . . . 1.02 108.86 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -59.14 -43.94 92.04 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.007 . . . . 0.15 108.691 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -64.62 -42.67 95.34 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.623 -0.88 . . . . 2.07 108.623 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.08 -36.85 85.37 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.67 -0.644 . . . . 1.77 109.963 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.13 -42.81 79.63 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.071 -1.018 . . . . 1.04 109.339 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.52 -39.36 87.56 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.124 -1.065 . . . . 1.07 108.124 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.61 -34.37 73.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.466 -0.771 . . . . 1.07 109.892 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.68 -37.8 70.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.21 -0.931 . . . . 1.07 110.3 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -32.44 73.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.254 -0.904 . . . . 1.03 109.309 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.63 -124.76 21.95 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.983 -1.247 . . . . 0.24 109.983 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -91.41 4.74 51.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.397 -1.061 . . . . 1.07 110.271 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -76.54 149.3 36.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.154 -0.966 . . . . 2.03 109.096 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.448 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.86 156.68 16.76 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.503 -1.295 . . . . 1.23 107.503 179.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.448 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 97.8 t -143.09 113.15 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.932 -1.105 . . . . 1.03 108.676 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.1 t -100.02 139.79 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.443 -0.947 . . . . 1.03 108.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.2 t -124.03 122.09 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.416 -0.803 . . . . 1.01 110.832 -178.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.528 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.7 t70 -98.44 120.24 38.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.631 -0.668 . . . . 1.05 110.305 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.53 25.74 4.89 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.96 -1.088 . . . . 0.73 109.756 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.0 m -59.43 143.25 50.35 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 120.878 -1.139 . . . . 0.84 110.453 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.14 127.96 33.66 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 106.979 -1.489 . . . . 1.04 106.979 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -67.35 -32.25 73.06 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 118.894 -1.122 . . . . 1.08 108.318 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.504 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 61.3 p-90 -73.06 -19.8 61.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.023 -1.048 . . . . 0.29 110.657 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.2 t -85.24 116.73 23.76 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.736 -1.228 . . . . 0.26 107.867 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.451 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.57 -51.78 55.4 Favored Glycine 0 N--CA 1.496 2.662 0 O-C-N 121.659 -0.65 . . . . 0.28 111.978 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.1 Cg_exo -52.83 -36.09 72.56 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 CA-C-N 118.464 1.132 . . . . 0.5 111.907 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.52 -52.57 9.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.516 -0.74 . . . . 1.04 110.301 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -59.94 -36.59 77.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.129 -0.982 . . . . 2.12 109.332 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.506 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.9 tmm? -59.9 -29.3 68.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.501 -0.749 . . . . 2.66 109.549 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.459 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 78.5 mt -79.44 -2.26 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.913 -0.492 . . . . 1.22 110.488 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.39 6.25 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 120.591 -1.318 . . . . 1.44 114.049 -177.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -57.24 -39.8 87.37 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 CA-C-N 121.842 1.693 . . . . 0.31 113.022 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -69.56 -48.52 60.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.262 -1.524 . . . . 0.45 108.651 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.06 -51.77 68.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.351 -0.843 . . . . 0.16 109.745 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -67.35 -40.94 85.87 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.589 -0.694 . . . . 0.35 110.385 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.481 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -61.31 -38.64 87.58 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.695 -1.253 . . . . 0.77 110.737 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.72 -21.52 66.44 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 1.07 110.701 -178.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -55.67 -35.62 66.2 Favored 'General case' 0 C--N 1.296 -1.721 0 O-C-N 120.894 -1.129 . . . . 0.87 108.277 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -85.97 -19.54 30.27 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.893 . . . . 2.16 109.897 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.24 -37.65 57.38 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 107.468 -1.308 . . . . 2.29 107.468 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.15 67.58 0.99 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.078 -1.453 . . . . 0.95 107.078 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.79 -8.27 10.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.037 -0.727 . . . . 0.89 109.037 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -90.67 10.2 26.73 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.115 -1.068 . . . . 1.13 108.115 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -129.56 142.08 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 107.696 -1.224 . . . . 1.06 107.696 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.442 HG22 HD11 ' A' ' 53' ' ' ILE . 26.8 mm -97.92 121.87 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.092 -1.005 . . . . 1.04 109.588 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -101.62 124.15 46.8 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.364 -0.835 . . . . 0.13 109.159 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 2.3 mp -109.81 146.17 35.49 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.759 -1.213 . . . . 1.08 109.382 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.8 129.21 56.51 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 106.98 -1.489 . . . . 1.13 106.98 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.0 t -124.91 132.32 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.503 0.668 . . . . 1.03 110.377 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -95.68 118.7 32.84 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.531 -0.914 . . . . 1.05 108.531 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -65.59 -18.76 24.47 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 O-C-N 120.121 -1.612 . . . . 1.04 107.862 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.504 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.45 -40.85 10.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.631 . . . . 1.08 112.23 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -95.61 -20.89 18.6 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.249 -1.532 . . . . 1.07 108.632 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.69 41.02 3.38 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.732 -1.21 . . . . 1.03 107.732 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -60.03 -20.66 59.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.579 -0.701 . . . . 1.92 110.097 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -62.77 -38.03 89.0 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 120.874 -1.141 . . . . 1.05 109.445 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.53 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 21.3 t -75.18 -44.46 43.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.013 -1.054 . . . . 1.1 109.825 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.34 -39.1 78.35 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.552 -0.859 . . . . 1.03 110.206 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -60.79 -36.48 79.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.007 -1.058 . . . . 0.89 108.539 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.489 ' OE2' ' NZ ' ' A' ' 8' ' ' LYS . 42.0 tt0 -63.09 -39.02 93.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 2.06 109.408 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.39 -0.06 55.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 1.05 110.697 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 53.09 50.2 18.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.966 -1.084 . . . . 2.02 109.728 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -66.55 132.38 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.859 -1.151 . . . . 1.05 109.35 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -103.19 -8.37 20.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.578 -0.701 . . . . 2.16 110.767 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.46 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.62 156.16 17.95 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.573 -1.33 . . . . 1.04 111.191 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.43 153.76 80.64 Favored Pre-proline 0 N--CA 1.502 2.148 0 N-CA-C 107.274 -1.38 . . . . 1.04 107.274 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -75.81 143.74 77.85 Favored 'Cis proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.848 -1.313 . . . . 0.19 112.788 -2.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.45 ' CG2' ' OE2' ' A' ' 88' ' ' GLU . 98.3 m -129.13 134.31 48.0 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.808 0.813 . . . . 1.04 108.953 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.528 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.4 m-85 -110.44 129.43 55.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 109.329 -0.619 . . . . 0.23 109.329 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -122.53 141.24 51.88 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.451 -0.944 . . . . 0.43 108.451 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -108.27 132.07 54.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.673 -0.642 . . . . 0.17 110.399 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -125.41 145.67 49.95 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.337 -0.616 . . . . 0.17 109.337 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -145.92 127.47 15.1 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.305 -1.368 . . . . 2.18 107.305 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 58.35 23.19 10.23 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.121 -1.066 . . . . 1.8 108.121 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 82.02 15.88 73.74 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 110.105 -1.198 . . . . 0.23 110.105 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.5 mm-40 -116.2 138.01 51.64 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.519 -0.989 . . . . 2.75 109.891 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -81.28 121.5 26.25 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.012 -1.107 . . . . 2.3 108.012 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.2 m -121.28 13.3 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.572 -0.705 . . . . 1.06 110.254 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -180.0 156.93 19.2 Favored Glycine 0 N--CA 1.496 2.637 0 C-N-CA 118.897 -1.621 . . . . 0.22 111.071 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.471 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 2.2 tp10 -166.84 147.73 5.91 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.65 -0.912 . . . . 1.93 108.727 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.456 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 11.0 p90 -166.98 162.58 15.69 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.199 -1.0 . . . . 0.16 108.945 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -128.88 169.61 14.4 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.621 0.724 . . . . 0.9 109.821 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 113.39 141.96 8.12 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.198 -1.561 . . . . 0.12 109.198 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.01 66.46 5.5 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.35 -1.088 . . . . 1.04 109.779 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -119.05 100.06 7.11 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.853 -1.166 . . . . 1.36 107.853 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -33.37 73.57 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.352 -0.842 . . . . 1.6 111.924 -178.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -64.6 -29.49 70.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.802 -1.186 . . . . 1.61 110.051 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.413 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 55.2 tttp -61.9 -34.87 76.84 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.699 -0.852 . . . . 2.02 108.699 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.4 mt -59.48 -40.02 85.63 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 122.279 1.038 . . . . 1.05 108.484 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -62.61 -42.51 99.62 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.545 -0.752 . . . . 2.1 110.981 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.75 77.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.101 -0.999 . . . . 1.06 111.288 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -64.76 -39.59 93.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.773 -1.205 . . . . 1.04 110.129 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.413 ' O ' ' N ' ' A' ' 105' ' ' VAL . 65.4 mt -61.55 -49.41 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 1.04 108.509 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -60.26 -35.55 75.77 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.046 0.927 . . . . 1.09 108.613 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -67.32 -40.13 85.92 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.66 -0.65 . . . . 2.21 109.654 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.2 mt -98.74 -3.94 34.61 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.545 -0.722 . . . . 1.05 111.458 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.413 ' N ' ' O ' ' A' ' 101' ' ' ILE . 6.0 p . . . . . 0 N--CA 1.497 1.897 0 O-C-N 120.392 -1.443 . . . . 1.08 108.807 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp . . . . . 0 N--CA 1.492 1.638 0 N-CA-C 109.711 -0.477 . . . . 1.89 109.711 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 30.4 mm -128.8 140.42 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.914 -0.491 . . . . 1.03 110.304 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -95.66 129.76 42.76 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.224 -1.399 . . . . 0.19 107.224 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.6 m -78.52 140.58 38.54 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.757 -1.214 . . . . 0.93 111.049 -178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.46 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.0 m95 -76.12 -8.44 57.01 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.699 -1.25 . . . . 0.21 108.975 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 m120 . . . . . 0 C--N 1.3 -1.564 0 O-C-N 121.124 -0.985 . . . . 0.49 108.739 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.2 tptt . . . . . 0 N--CA 1.499 1.989 0 N-CA-C 108.848 -0.797 . . . . 2.18 108.848 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -97.79 124.11 42.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.383 -0.823 . . . . 0.4 109.288 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.28 115.85 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.349 -0.845 . . . . 1.04 108.788 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -99.67 -0.89 39.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.265 -0.897 . . . . 2.25 108.978 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -151.68 153.88 35.25 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.046 . . . . 0.91 111.04 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -64.3 -31.55 72.8 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.254 -1.017 . . . . 2.18 108.254 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.5 m -58.15 -47.21 84.07 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.382 -0.927 . . . . 1.03 108.601 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.12 -30.9 70.15 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.515 -0.74 . . . . 1.02 109.107 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -59.35 -44.05 92.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.252 -0.905 . . . . 0.15 108.977 -179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -65.41 -41.85 93.17 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.404 -0.961 . . . . 2.07 108.404 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.37 -37.49 87.7 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.664 -0.648 . . . . 1.77 110.299 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.12 79.14 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.277 -0.89 . . . . 1.04 109.586 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -60.15 -40.63 90.52 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.166 -0.959 . . . . 1.07 108.537 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -68.48 -37.08 79.82 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.654 -0.653 . . . . 1.07 110.243 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.06 -36.65 80.21 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.44 -0.787 . . . . 1.07 110.406 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.31 -33.11 74.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.041 -1.037 . . . . 1.03 109.294 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.19 20.18 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.268 -1.133 . . . . 0.24 110.268 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.474 ' CG ' ' HZ2' ' A' ' 82' ' ' LYS . 71.0 m-20 -89.92 0.53 57.02 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.263 -1.139 . . . . 1.07 110.457 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -73.98 147.59 42.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.825 -1.172 . . . . 2.03 109.401 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.502 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.21 159.73 7.25 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.118 -1.438 . . . . 1.23 107.118 179.79 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.502 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 96.0 t -146.41 121.27 2.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 O-C-N 120.812 -1.18 . . . . 1.03 108.605 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.6 t -109.59 140.0 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.305 -0.998 . . . . 1.03 108.305 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.59 121.27 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.329 -0.857 . . . . 1.01 109.557 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.2 t70 -98.41 117.61 33.21 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.457 -0.777 . . . . 1.05 109.756 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -94.48 25.72 3.78 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.142 -0.974 . . . . 0.73 110.02 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.414 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 53.2 m -59.31 146.62 38.92 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 121.102 -0.999 . . . . 0.84 110.616 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 126.82 32.64 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.785 -1.191 . . . . 1.04 107.785 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.13 -31.61 71.31 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.938 -1.105 . . . . 1.08 108.909 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.529 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 56.1 p-90 -74.1 -22.4 59.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.427 -0.795 . . . . 0.29 111.04 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -83.39 110.44 18.15 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.74 -1.207 . . . . 0.26 107.74 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.474 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.86 -50.35 68.49 Favored Glycine 0 N--CA 1.485 1.907 0 C-N-CA 120.258 -0.972 . . . . 0.28 110.772 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.5 Cg_exo -52.48 -34.86 63.79 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 CA-C-N 118.88 1.34 . . . . 0.5 111.804 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.01 -50.73 11.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 1.04 110.247 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -60.19 -35.27 75.02 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.05 -1.031 . . . . 2.12 109.37 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.3 ttt -58.68 -27.32 64.71 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.391 -0.818 . . . . 2.66 109.571 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.0 mt -85.02 -3.77 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.694 -0.629 . . . . 1.22 110.882 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.547 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.5 ptmt -66.94 -27.05 1.6 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 120.278 -1.514 . . . . 1.44 113.315 -177.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.9 Cg_exo -56.38 -39.33 91.98 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 CA-C-N 122.349 1.875 . . . . 0.31 112.117 -177.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -68.17 -46.06 71.77 Favored 'General case' 0 C--N 1.301 -1.506 0 C-N-CA 118.181 -1.408 . . . . 0.45 108.458 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -60.11 -52.1 66.79 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.914 0.864 . . . . 0.16 109.406 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -67.27 -45.57 76.24 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.7 -0.625 . . . . 0.35 110.244 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.3 m -60.2 -38.4 83.2 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.263 -0.898 . . . . 0.77 110.601 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 mt -63.08 -24.48 67.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.086 -1.009 . . . . 1.07 110.753 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.4 m -53.4 -36.24 61.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.872 -1.142 . . . . 0.87 108.745 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 mp0 -85.3 -15.98 41.57 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.035 -1.041 . . . . 2.16 108.627 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.0 -37.61 38.77 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.393 -1.336 . . . . 2.29 107.393 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -123.69 69.05 1.03 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.338 -1.356 . . . . 0.95 107.338 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -65.66 -13.45 59.21 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 108.35 -0.981 . . . . 0.89 108.35 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -82.23 -3.74 55.69 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.321 -0.992 . . . . 1.13 108.321 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.43 141.75 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 N-CA-C 107.463 -1.31 . . . . 1.06 107.463 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -97.96 122.38 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.172 -0.955 . . . . 1.04 109.822 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -101.06 131.51 46.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.311 -0.868 . . . . 0.13 110.419 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.43 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 6.4 mp -116.33 140.96 48.78 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.288 -0.883 . . . . 1.08 109.243 178.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -110.21 130.01 55.62 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.843 -1.54 . . . . 1.13 106.843 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.99 135.11 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.253 -0.904 . . . . 1.03 110.663 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -97.03 119.76 36.12 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.76 -0.83 . . . . 1.05 108.76 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 28.1 m -68.85 -17.63 22.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.786 -1.197 . . . . 1.04 108.213 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.529 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.5 m-20 -94.24 -41.02 9.69 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.403 -0.81 . . . . 1.08 112.041 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -96.86 -16.56 20.69 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.598 -1.314 . . . . 1.07 108.293 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.09 39.89 3.86 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.03 -1.1 . . . . 1.03 108.03 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -60.08 -24.56 64.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.676 -0.64 . . . . 1.92 110.224 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.4 p30 -63.71 -37.33 86.94 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.812 -1.18 . . . . 1.05 108.739 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.518 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 8.1 t -70.34 -44.04 77.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.271 -0.893 . . . . 1.1 109.587 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.52 67.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.516 -0.74 . . . . 1.03 111.178 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.441 ' HG ' ' N ' ' A' ' 68' ' ' GLU . 94.7 p -60.26 -35.72 76.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.948 -1.095 . . . . 0.89 109.541 -179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.441 ' N ' ' HG ' ' A' ' 67' ' ' SER . 14.6 tm-20 -63.65 -36.9 85.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.292 -0.88 . . . . 2.06 109.181 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.44 -2.21 58.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.23 -0.919 . . . . 1.05 110.884 -178.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 55.44 49.04 17.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.04 -1.038 . . . . 2.02 109.847 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.4 t -64.05 133.02 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 C-N-CA 118.574 -1.25 . . . . 1.05 108.442 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -104.86 -12.36 16.29 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.639 -0.663 . . . . 2.16 109.936 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.55 155.99 20.34 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.849 -1.157 . . . . 1.04 111.207 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -129.31 155.51 79.89 Favored Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 107.859 -1.163 . . . . 1.04 107.859 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -76.05 141.77 71.56 Favored 'Cis proline' 0 N--CA 1.493 1.469 0 C-N-CA 123.749 -1.355 . . . . 0.19 112.675 -1.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -127.38 137.3 52.72 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.597 -0.89 . . . . 1.04 108.597 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.556 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 90.9 m-85 -113.74 130.04 56.49 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 108.612 -0.884 . . . . 0.23 108.612 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . 0.461 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 80.9 mt-30 -120.57 140.02 52.11 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.269 -0.894 . . . . 0.43 108.673 179.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -107.48 133.01 52.6 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.436 0.636 . . . . 0.17 110.318 -179.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . 0.444 ' CZ ' ' NZ ' ' A' ' 85' ' ' LYS . 80.1 m-85 -128.61 145.92 51.0 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 108.996 -0.742 . . . . 0.17 108.996 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -147.81 131.24 16.66 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.16 -1.422 . . . . 2.18 107.16 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.474 ' HZ2' ' CG ' ' A' ' 20' ' ' ASP . 68.6 mttm 56.01 27.93 12.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.279 -0.888 . . . . 1.8 109.549 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.86 15.29 79.5 Favored Glycine 0 N--CA 1.493 2.485 0 C-N-CA 120.061 -1.066 . . . . 0.23 110.902 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -125.06 141.54 52.06 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.088 -1.243 . . . . 2.75 110.508 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.461 ' NZ ' ' OE1' ' A' ' 78' ' ' GLN . 20.3 ttmm -78.56 126.98 31.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.274 -0.892 . . . . 2.3 109.392 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.89 11.75 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.728 -0.608 . . . . 1.06 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.93 154.14 14.52 Favored Glycine 0 N--CA 1.494 2.552 0 C-N-CA 118.388 -1.863 . . . . 0.22 111.743 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 3.2 tp10 -165.14 136.49 4.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.997 -0.708 . . . . 1.93 109.642 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.543 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.9 p90 -163.26 158.5 21.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.328 -0.857 . . . . 0.16 109.947 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -127.97 160.18 32.7 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.61 0.719 . . . . 0.9 110.37 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 126.56 141.88 5.55 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.394 -1.482 . . . . 0.12 109.394 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.2 65.17 2.12 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.339 -1.095 . . . . 1.04 109.626 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.0 97.78 5.77 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.353 -0.842 . . . . 1.36 108.77 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -33.28 73.31 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.017 -1.052 . . . . 1.6 111.174 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.18 -30.08 70.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.953 -1.092 . . . . 1.61 109.68 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.54 -34.72 74.55 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.566 -0.709 . . . . 2.02 109.337 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.4 mt -59.44 -40.07 85.59 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.551 -0.907 . . . . 1.05 108.551 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.95 -43.92 97.48 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 119.402 -0.919 . . . . 2.1 110.347 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.62 -44.81 77.1 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.136 -1.026 . . . . 1.06 110.624 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.0 m -64.3 -40.06 95.18 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.793 -1.192 . . . . 1.04 108.478 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.95 -46.64 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 107.503 -1.295 . . . . 1.04 107.503 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.12 -35.94 76.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.05 -1.093 . . . . 1.09 108.05 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -68.73 -40.1 80.05 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.626 -0.671 . . . . 2.21 110.164 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.6 mt -98.26 -2.73 38.9 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.143 -0.973 . . . . 1.05 111.63 -178.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.499 1.999 0 O-C-N 120.504 -1.372 . . . . 1.08 109.551 -179.246 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.706 -0.479 . . . . 1.89 109.706 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 36.3 mm -130.04 141.44 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.812 -0.555 . . . . 1.03 109.754 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 24.2 m -99.9 131.51 45.83 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 106.934 -1.506 . . . . 0.19 106.934 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -84.06 142.69 30.24 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.661 -1.275 . . . . 0.93 111.441 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.408 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.4 m95 -75.44 -11.14 59.98 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.216 -0.927 . . . . 0.21 108.995 178.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . 0.411 ' N ' HD21 ' B' ' 68' ' ' ASN . 2.0 m120 . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 108.513 -0.921 . . . . 0.49 108.513 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.707 -0.849 . . . . 2.18 108.707 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -98.18 124.07 42.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.633 -0.877 . . . . 0.4 108.633 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.0 mm -101.16 112.66 34.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.956 -0.757 . . . . 1.04 108.956 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.468 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.0 mp0 -95.53 -0.2 52.36 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.195 -0.94 . . . . 2.25 109.464 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -156.04 159.33 39.04 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.909 -1.119 . . . . 0.91 111.166 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -65.41 -31.92 73.27 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.174 -1.047 . . . . 2.18 108.174 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.8 m -58.01 -49.46 76.76 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.517 -0.873 . . . . 1.03 109.067 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.26 69.24 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.323 -0.86 . . . . 1.02 109.042 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -58.48 -43.58 89.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.037 -1.039 . . . . 0.15 108.713 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -64.56 -43.87 92.54 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.966 -0.753 . . . . 2.07 108.966 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.59 -36.26 83.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.645 -0.66 . . . . 1.77 110.059 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.32 80.89 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.165 -0.959 . . . . 1.04 109.19 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.7 mt -61.14 -41.18 96.27 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.186 -0.946 . . . . 1.07 109.016 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -68.46 -35.26 77.32 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.628 -0.67 . . . . 1.07 110.508 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -39.58 81.18 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.271 -0.893 . . . . 1.07 110.234 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' A' ' 23' ' ' VAL . . . -60.85 -34.6 74.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.386 -0.821 . . . . 1.03 109.746 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -124.58 21.2 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.648 -1.381 . . . . 0.24 109.648 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -90.75 -1.53 57.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 120.982 -1.304 . . . . 1.07 110.51 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -75.02 149.99 39.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.934 -1.104 . . . . 2.03 108.805 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mt -58.79 160.03 6.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.09 -1.006 . . . . 1.23 110.543 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.4 ' CG2' ' CB ' ' A' ' 18' ' ' ALA . 62.9 t -148.0 111.75 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 107.974 -1.121 . . . . 1.03 107.974 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.8 t -103.66 144.19 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 107.47 -1.308 . . . . 1.03 107.47 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.9 t -125.34 122.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.192 -0.942 . . . . 1.01 110.549 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.541 ' CG ' ' HG ' ' A' ' 28' ' ' SER . 48.2 t0 -99.53 117.41 33.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.377 -0.827 . . . . 1.05 109.932 179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -94.12 26.45 3.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.937 . . . . 0.73 110.179 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.541 ' HG ' ' CG ' ' A' ' 26' ' ' ASP . 51.9 m -60.3 144.65 50.01 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.823 -1.173 . . . . 0.84 110.16 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.57 125.5 32.49 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.43 -0.952 . . . . 1.04 108.43 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.0 t -65.59 -32.71 74.44 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.105 -0.997 . . . . 1.08 108.729 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.551 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 54.7 p-90 -72.11 -23.22 61.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.196 -0.94 . . . . 0.29 111.03 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.5 t -81.05 123.19 28.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.768 -1.207 . . . . 0.26 108.734 -179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.414 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.94 -56.53 22.0 Favored Glycine 0 N--CA 1.493 2.446 0 O-C-N 121.637 -0.664 . . . . 0.28 112.159 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 8.0 Cg_endo -59.94 -29.48 89.5 Favored 'Trans proline' 0 C--N 1.314 -1.267 0 CA-C-N 119.45 1.625 . . . . 0.5 112.605 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.22 -54.99 5.81 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.844 -1.16 . . . . 1.04 109.918 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt -60.26 -39.32 86.36 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.085 -1.009 . . . . 2.12 109.444 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.512 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.3 tmt? -59.76 -28.92 67.8 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.653 -0.654 . . . . 2.66 109.89 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.459 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 68.0 mt -80.73 -3.7 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.708 -0.62 . . . . 1.22 110.454 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.4 ptmt -65.12 -27.6 2.3 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 120.486 -1.384 . . . . 1.44 113.295 -177.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.0 Cg_exo -55.93 -39.27 92.19 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 CA-C-N 122.563 1.951 . . . . 0.31 112.888 -176.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.12 -45.01 71.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.632 -1.292 . . . . 0.45 108.842 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.38 -52.81 63.08 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.121 -0.987 . . . . 0.16 109.454 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.0 t60 -68.22 -40.29 82.12 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.774 -0.578 . . . . 0.35 110.678 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.8 m -62.61 -39.62 94.34 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.77 111.374 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -63.92 -19.43 65.1 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.912 -1.117 . . . . 1.07 110.372 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.4 m -55.16 -38.43 68.29 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 120.755 -1.216 . . . . 0.87 108.481 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -83.2 -17.59 42.24 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.031 -1.043 . . . . 2.16 109.635 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -77.93 -35.9 49.96 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.453 -1.314 . . . . 2.29 107.453 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -122.46 68.15 0.95 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.077 -1.453 . . . . 0.95 107.077 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.8 p -66.1 -9.61 32.78 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.642 -0.873 . . . . 0.89 108.642 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -88.91 6.66 38.29 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.056 -1.09 . . . . 1.13 108.056 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 78.7 t -127.05 146.41 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 107.885 -1.154 . . . . 1.06 107.885 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.408 HG22 HD11 ' A' ' 53' ' ' ILE . 22.8 mm -99.98 123.84 53.05 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 120.822 -1.174 . . . . 1.04 109.777 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -105.72 125.59 51.16 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.273 -0.892 . . . . 0.13 109.179 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.441 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 3.2 mp -110.33 141.18 43.71 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.984 -1.073 . . . . 1.08 109.566 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -110.89 131.67 54.85 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 106.517 -1.66 . . . . 1.13 106.517 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.3 t -126.49 137.52 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.404 -0.81 . . . . 1.03 110.097 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -99.06 119.22 37.46 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 107.821 -1.178 . . . . 1.05 107.821 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -67.99 -18.72 23.94 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 120.66 -1.275 . . . . 1.04 108.469 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.551 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -92.63 -41.19 10.33 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.548 -0.72 . . . . 1.08 111.819 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -96.48 -18.71 19.66 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.596 -1.315 . . . . 1.07 108.062 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.44 38.87 3.88 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.569 -1.271 . . . . 1.03 107.569 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -60.34 -23.51 64.31 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.702 -0.624 . . . . 1.92 109.947 -178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.54 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -64.82 -38.13 89.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.696 -1.253 . . . . 1.05 109.216 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.54 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 14.2 t -70.89 -44.16 76.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 121.786 0.803 . . . . 1.1 109.618 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.99 -39.71 72.3 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.685 -0.634 . . . . 1.03 110.5 -178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.4 p -59.97 -32.54 70.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.936 -1.102 . . . . 0.89 109.02 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -62.26 -39.04 91.59 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.438 -0.789 . . . . 2.06 108.901 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.22 0.2 57.31 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.559 -0.713 . . . . 1.05 110.923 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 53.29 49.97 18.63 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.996 -1.065 . . . . 2.02 109.684 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.18 133.13 30.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.735 -1.228 . . . . 1.05 108.684 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.2 -10.89 18.42 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.588 -0.695 . . . . 2.16 110.41 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.18 157.08 20.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.595 -1.316 . . . . 1.04 111.007 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -128.53 155.08 79.38 Favored Pre-proline 0 N--CA 1.501 2.115 0 N-CA-C 107.516 -1.29 . . . . 1.04 107.516 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -75.62 140.83 68.74 Favored 'Cis proline' 0 N--CA 1.493 1.461 0 C-N-CA 123.731 -1.362 . . . . 0.19 113.206 -3.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -126.03 137.32 53.64 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.057 -1.09 . . . . 1.04 108.057 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.434 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 90.2 m-85 -115.9 131.1 57.04 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.863 -1.162 . . . . 0.23 107.863 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -123.93 144.65 49.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.281 -0.887 . . . . 0.43 108.916 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -108.23 132.51 53.58 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.639 0.733 . . . . 0.17 110.693 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -126.86 143.37 51.29 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.662 -0.866 . . . . 0.17 108.662 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -146.72 128.37 15.18 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.536 -1.283 . . . . 2.18 107.536 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.2 mttp 59.22 28.22 17.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.467 -0.938 . . . . 1.8 108.467 -178.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.11 18.96 79.06 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.742 -1.343 . . . . 0.23 109.742 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -123.71 139.9 53.52 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.389 -1.065 . . . . 2.75 110.957 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -80.03 123.32 27.73 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.846 -0.798 . . . . 2.3 108.846 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.4 m -123.15 9.37 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.513 -0.742 . . . . 1.06 111.122 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.0 160.26 27.24 Favored Glycine 0 N--CA 1.498 2.768 0 C-N-CA 118.795 -1.669 . . . . 0.22 110.948 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.499 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.5 tp10 -169.01 148.0 4.0 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.627 -0.925 . . . . 1.93 109.612 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.499 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 5.6 p90 -168.63 157.39 8.56 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.471 -0.768 . . . . 0.16 109.911 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -128.47 160.09 33.38 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.611 -0.681 . . . . 0.9 109.5 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.39 143.49 6.33 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.312 -1.515 . . . . 0.12 109.312 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.12 67.64 3.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.05 -1.265 . . . . 1.04 110.207 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.82 95.31 4.66 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.478 -0.764 . . . . 1.36 108.985 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -32.21 70.97 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.143 -0.973 . . . . 1.6 111.679 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.89 -29.7 70.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.851 -1.155 . . . . 1.61 109.572 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -60.34 -35.45 75.68 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.46 0.647 . . . . 2.02 109.327 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.0 mt -59.26 -39.85 84.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 122.083 0.945 . . . . 1.05 108.709 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -62.35 -43.68 98.25 Favored 'General case' 0 C--N 1.288 -2.093 0 C-N-CA 120.104 -0.638 . . . . 2.1 110.98 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.29 -43.15 74.42 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.073 -1.017 . . . . 1.06 111.135 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.0 m -64.96 -39.91 94.19 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.825 -1.172 . . . . 1.04 110.147 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.28 -49.25 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 1.04 108.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -60.56 -34.87 74.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.124 0.964 . . . . 1.09 108.653 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.8 tm-20 -67.86 -40.02 83.67 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.427 -0.796 . . . . 2.21 110.037 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.6 mt -100.2 -4.61 29.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.216 -0.928 . . . . 1.05 111.732 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.198 -1.564 . . . . 1.08 109.048 -179.004 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.847 -0.797 . . . . 1.89 108.847 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 26.5 mm -131.6 144.8 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.628 0 O-C-N 121.894 -0.504 . . . . 1.03 109.822 -179.888 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.88 132.08 50.48 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 107.522 -1.288 . . . . 0.19 107.522 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -82.56 140.74 33.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.807 -1.183 . . . . 0.93 111.054 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.431 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.7 m95 -76.97 -7.94 56.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.896 -1.128 . . . . 0.21 108.458 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--N 1.304 -1.38 0 N-CA-C 108.374 -0.972 . . . . 0.49 108.374 -179.759 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 tptt . . . . . 0 N--CA 1.497 1.875 0 N-CA-C 108.464 -0.939 . . . . 2.18 108.464 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -98.89 122.25 41.89 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.295 -0.878 . . . . 0.4 108.878 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.421 HD11 HG22 ' A' ' 5' ' ' ILE . 26.7 mm -100.06 114.65 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 N-CA-C 108.673 -0.862 . . . . 1.04 108.673 179.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -99.77 -0.08 40.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.258 -0.902 . . . . 2.25 109.547 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -154.29 156.83 37.7 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.966 -1.084 . . . . 0.91 110.982 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -64.24 -32.21 73.71 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.974 -1.121 . . . . 2.18 107.974 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -56.49 -47.49 79.14 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.539 -0.912 . . . . 1.03 108.539 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.71 -31.6 69.7 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.439 -0.788 . . . . 1.02 109.243 178.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -58.7 -44.66 90.41 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.005 -1.059 . . . . 0.15 109.033 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -64.52 -42.2 95.93 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 108.832 -0.803 . . . . 2.07 108.832 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.58 -36.26 83.66 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.383 0.611 . . . . 1.77 110.399 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.82 77.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.301 -0.874 . . . . 1.04 108.999 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.5 mt -60.12 -40.05 88.39 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.96 -1.126 . . . . 1.07 107.96 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -69.81 -40.14 76.1 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.55 -0.719 . . . . 1.07 110.264 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.14 -32.37 68.87 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.37 -0.831 . . . . 1.07 110.457 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.59 -26.19 68.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.048 -1.033 . . . . 1.03 108.997 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.17 -130.91 30.04 Favored Glycine 0 N--CA 1.487 2.04 0 N-CA-C 109.8 -1.32 . . . . 0.24 109.8 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.62 3.0 56.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.233 -1.157 . . . . 1.07 110.729 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -73.44 149.49 42.38 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.886 -1.134 . . . . 2.03 109.665 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.511 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -58.52 158.72 7.25 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.056 -1.461 . . . . 1.23 107.056 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.511 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 85.3 t -143.91 109.69 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 120.93 -1.106 . . . . 1.03 108.816 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.2 t -98.64 141.27 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 108.222 -1.029 . . . . 1.03 108.222 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.9 t -124.17 122.41 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.503 -0.748 . . . . 1.01 109.518 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -99.3 116.45 31.5 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.275 -0.891 . . . . 1.05 109.633 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -92.41 20.43 6.18 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.061 -1.024 . . . . 0.73 109.875 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.29 146.09 20.13 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.735 -1.228 . . . . 0.84 110.483 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.6 122.4 30.48 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.927 -1.138 . . . . 1.04 107.927 179.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -63.81 -29.86 71.02 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.062 -1.055 . . . . 1.08 108.582 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.521 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 63.6 p-90 -74.88 -17.88 60.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.312 -0.867 . . . . 0.29 110.694 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -84.76 119.53 25.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.792 -1.193 . . . . 0.26 108.55 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.449 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.97 -54.14 39.33 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.894 -0.67 . . . . 0.28 112.247 -178.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.449 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.9 Cg_endo -60.18 -29.95 90.21 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 CA-C-N 119.286 1.543 . . . . 0.5 112.426 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.49 -48.01 20.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.051 . . . . 1.04 109.753 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -59.97 -32.48 70.86 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.18 -0.95 . . . . 2.12 109.09 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.501 ' O ' ' SD ' ' A' ' 37' ' ' MET . 15.1 tmm? -59.09 -26.95 65.09 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.34 -0.85 . . . . 2.66 110.041 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.0 mt -82.21 -5.72 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.398 -0.814 . . . . 1.22 111.223 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.02 -30.36 7.18 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 119.802 -1.811 . . . . 1.44 113.336 -178.203 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.3 Cg_exo -60.0 -42.46 44.1 Favored 'Trans proline' 0 C--O 1.204 -1.189 0 CA-C-N 121.518 1.578 . . . . 0.31 112.027 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.22 -48.81 60.93 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 118.525 -1.27 . . . . 0.45 109.362 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.16 -52.82 63.7 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.806 0.812 . . . . 0.16 109.775 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -67.87 -40.32 83.61 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.797 -0.564 . . . . 0.35 111.033 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.492 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.6 m -64.2 -38.2 90.19 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.77 -1.206 . . . . 0.77 110.777 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.14 -20.5 65.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.141 -0.974 . . . . 1.07 111.142 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -52.95 -40.53 63.74 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 120.824 -1.173 . . . . 0.87 109.075 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -84.92 -16.64 40.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.115 -0.991 . . . . 2.16 109.432 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -76.21 -37.95 57.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.24 -1.393 . . . . 2.29 107.24 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.482 ' C ' ' H ' ' A' ' 51' ' ' ASN . 84.3 m-85 -123.63 68.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.282 -1.377 . . . . 0.95 107.282 177.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.3 p -62.81 -5.12 2.52 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.104 -1.073 . . . . 0.89 108.104 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.9 t-20 -80.48 -20.2 44.23 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.921 -0.77 . . . . 1.13 108.921 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 62.4 t -109.55 147.61 13.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 N-CA-C 108.465 -0.939 . . . . 1.06 108.465 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.438 HG22 HD11 ' A' ' 53' ' ' ILE . 31.2 mm -99.77 118.36 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 108.695 -0.854 . . . . 1.04 108.695 -179.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -97.43 124.99 41.81 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.021 -1.05 . . . . 0.13 109.798 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.482 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 4.5 mp -110.07 141.75 42.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.264 -0.898 . . . . 1.08 108.969 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -109.79 130.17 55.55 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.881 -1.526 . . . . 1.13 106.881 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.7 t -125.76 135.48 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.384 -0.822 . . . . 1.03 110.414 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -97.38 118.87 34.83 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.474 -0.766 . . . . 1.05 109.145 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.9 m -66.12 -20.46 27.3 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 120.584 -1.322 . . . . 1.04 108.392 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.521 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 19.0 m-20 -91.41 -44.05 9.37 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.551 -0.718 . . . . 1.08 112.077 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -95.21 -14.46 24.05 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.582 -1.324 . . . . 1.07 108.892 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.92 37.82 4.32 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.349 -1.352 . . . . 1.03 107.349 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -59.93 -21.17 60.79 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 121.128 0.49 . . . . 1.92 110.116 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -65.5 -39.15 91.54 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.906 -1.121 . . . . 1.05 108.482 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.529 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 15.4 t -70.95 -45.67 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.434 -0.791 . . . . 1.1 109.527 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -37.42 75.84 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.545 -0.722 . . . . 1.03 110.884 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.2 p -60.56 -38.0 83.11 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.978 -1.077 . . . . 0.89 109.845 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.1 -38.89 92.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.192 -0.942 . . . . 2.06 109.88 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -83.46 -2.97 57.11 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 1.05 109.909 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 55.08 49.84 16.63 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.357 -0.84 . . . . 2.02 109.479 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.39 130.16 27.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.708 -1.197 . . . . 1.05 108.568 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -102.28 -10.98 19.06 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.701 -0.624 . . . . 2.16 110.57 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.482 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.87 155.77 16.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.687 -1.258 . . . . 1.04 110.962 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -129.67 155.32 80.52 Favored Pre-proline 0 N--CA 1.504 2.238 0 N-CA-C 108.563 -0.902 . . . . 1.04 108.563 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -75.38 142.16 73.5 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.882 -1.299 . . . . 0.19 113.073 -2.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.482 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 87.2 m -127.3 136.23 51.65 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 108.553 -0.906 . . . . 1.04 108.553 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.468 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 92.7 m-85 -114.09 130.14 56.59 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 108.674 -0.861 . . . . 0.23 108.674 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -121.97 140.85 51.95 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.704 -0.85 . . . . 0.43 108.704 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -107.75 132.16 53.68 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.544 0.688 . . . . 0.17 110.887 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -127.21 149.37 50.02 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.472 0.653 . . . . 0.17 109.476 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -149.55 125.13 10.35 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.623 -1.251 . . . . 2.18 107.623 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.2 mttt 58.82 28.41 17.39 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.811 -1.181 . . . . 1.8 107.811 -178.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.55 13.51 83.43 Favored Glycine 0 N--CA 1.487 2.073 0 N-CA-C 110.049 -1.22 . . . . 0.23 110.049 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -114.78 134.69 54.91 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.269 -1.136 . . . . 2.75 110.409 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -81.32 121.91 26.79 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.55 -0.907 . . . . 2.3 108.55 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.2 m -125.16 16.33 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.628 -0.67 . . . . 1.06 110.607 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.43 155.47 15.15 Favored Glycine 0 N--CA 1.495 2.624 0 C-N-CA 118.924 -1.607 . . . . 0.22 110.994 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.3 tp10 -168.0 149.32 5.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.619 -0.882 . . . . 1.93 108.619 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.483 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.0 p90 -168.5 158.86 9.85 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.134 -0.979 . . . . 0.16 109.434 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -127.19 162.33 26.41 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.388 -0.82 . . . . 0.9 110.335 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.44 142.77 6.46 Favored Glycine 0 N--CA 1.503 3.119 0 N-CA-C 109.985 -1.246 . . . . 0.12 109.985 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.27 64.53 2.69 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.028 -1.278 . . . . 1.04 110.208 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.61 97.82 5.93 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.264 -1.013 . . . . 1.36 108.264 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -32.63 71.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.185 -0.947 . . . . 1.6 111.461 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.46 -30.82 71.88 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.975 -1.078 . . . . 1.61 109.371 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.94 -34.7 75.13 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.323 0.582 . . . . 2.02 109.58 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.9 mt -59.53 -37.81 79.34 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.039 0.923 . . . . 1.05 108.574 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -64.09 -42.04 97.07 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 120.3 -0.56 . . . . 2.1 111.425 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -43.94 77.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.961 -1.087 . . . . 1.06 111.565 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -65.75 -38.91 90.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.834 -1.166 . . . . 1.04 109.72 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.93 -49.97 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.041 -1.037 . . . . 1.04 108.405 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -60.14 -34.9 74.18 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-O 122.091 0.948 . . . . 1.09 108.458 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -67.91 -39.88 83.51 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.574 -0.703 . . . . 2.21 109.938 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.8 mt -99.52 -1.69 37.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.202 -0.936 . . . . 1.05 111.414 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.4 ' O ' ' CG1' ' A' ' 105' ' ' VAL . 9.2 p . . . . . 0 N--CA 1.496 1.872 0 O-C-N 120.297 -1.502 . . . . 1.08 109.1 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 109.839 -0.43 . . . . 1.89 109.839 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 29.4 mm -128.88 139.86 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 109.462 -0.57 . . . . 1.03 109.462 -179.622 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.8 m -100.22 127.77 46.43 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -79.47 142.37 35.91 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.811 -1.181 . . . . 0.93 111.161 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 22.3 m95 -78.09 -12.19 59.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.254 -0.904 . . . . 0.21 109.435 179.372 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 108.263 -1.014 . . . . 0.49 108.263 179.624 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 N--CA 1.5 2.041 0 N-CA-C 108.214 -1.032 . . . . 2.18 108.214 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -97.07 125.23 41.39 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.202 -0.937 . . . . 0.4 109.341 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 mm -103.64 115.76 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 108.663 -0.866 . . . . 1.04 108.663 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -99.32 -0.16 41.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.137 -0.977 . . . . 2.25 109.778 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.87 155.58 37.34 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.726 -1.234 . . . . 0.91 111.068 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -65.0 -31.5 72.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.461 -0.94 . . . . 2.18 108.461 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.5 m -58.65 -47.99 82.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 1.03 109.157 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.74 66.11 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.277 -0.889 . . . . 1.02 109.143 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -60.05 -44.37 94.74 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.098 -1.001 . . . . 0.15 108.741 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -64.75 -43.04 94.6 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.855 -0.795 . . . . 2.07 108.855 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.01 -36.49 84.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.203 0.525 . . . . 1.77 110.487 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.08 -42.05 80.96 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.266 -0.896 . . . . 1.04 109.221 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.26 -40.1 89.16 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.602 -0.888 . . . . 1.07 108.602 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -67.98 -36.78 80.6 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.485 0.66 . . . . 1.07 110.337 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.71 -39.2 84.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.485 -0.759 . . . . 1.07 110.56 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.89 -32.16 71.62 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.234 -0.916 . . . . 1.03 109.45 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.09 -124.91 17.83 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.809 -1.316 . . . . 0.24 109.809 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -91.77 4.02 53.77 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.109 -1.23 . . . . 1.07 110.367 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -76.2 147.89 38.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.047 -1.033 . . . . 2.03 109.482 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.479 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.25 158.69 8.7 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.249 -1.389 . . . . 1.23 107.249 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.479 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 88.3 t -146.07 113.09 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.633 -1.292 . . . . 1.03 108.873 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.1 t -99.69 141.33 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 108.401 -0.962 . . . . 1.03 108.401 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.8 t -124.1 123.72 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.196 -0.94 . . . . 1.01 109.681 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.8 t70 -100.98 116.66 33.34 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.407 -0.808 . . . . 1.05 110.687 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -94.41 24.2 4.68 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.23 -0.919 . . . . 0.73 110.991 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -59.56 149.28 30.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 120.756 -1.215 . . . . 0.84 110.647 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.06 124.8 32.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.175 -1.417 . . . . 1.04 107.175 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.35 -30.38 70.76 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 118.896 -1.121 . . . . 1.08 108.042 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.538 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 67.0 p-90 -75.7 -13.85 60.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.423 -0.798 . . . . 0.29 110.741 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.3 t -85.78 118.3 25.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.745 -1.222 . . . . 0.26 108.225 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.42 -54.08 38.98 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 120.73 -0.748 . . . . 0.28 112.265 -177.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.7 Cg_endo -60.44 -29.86 89.6 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 CA-C-N 119.539 1.669 . . . . 0.5 112.183 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.2 -47.77 22.87 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.015 -1.053 . . . . 1.04 109.726 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -60.05 -32.11 70.61 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.252 -0.905 . . . . 2.12 109.787 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 44.6 ttm -59.93 -29.3 68.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.506 -0.746 . . . . 2.66 110.12 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -79.76 -4.52 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.701 -0.624 . . . . 1.22 111.026 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.532 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.53 -31.24 8.53 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 120.188 -1.57 . . . . 1.44 113.712 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.1 Cg_exo -59.63 -38.85 79.19 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 CA-C-N 121.756 1.663 . . . . 0.31 112.159 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -71.23 -50.69 30.36 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 118.763 -1.175 . . . . 0.45 108.894 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -59.97 -47.35 86.18 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.099 -1.001 . . . . 0.16 109.178 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -68.91 -42.37 76.97 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.588 -0.695 . . . . 0.35 111.282 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 66.3 m -65.91 -39.15 90.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.905 -1.122 . . . . 0.77 110.622 -179.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.93 -22.46 62.47 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.201 -0.937 . . . . 1.07 110.308 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -56.76 -35.27 68.44 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.855 -1.153 . . . . 0.87 108.835 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -89.48 -12.62 39.57 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.957 -1.089 . . . . 2.16 109.503 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 ttmm -81.84 -36.08 28.68 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.182 -1.414 . . . . 2.29 107.182 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.443 ' C ' ' H ' ' A' ' 51' ' ' ASN . 79.5 m-85 -122.09 67.34 0.92 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 107.284 -1.376 . . . . 0.95 107.284 178.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 p -63.61 -7.03 6.17 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 107.841 -1.17 . . . . 0.89 107.841 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.8 t-20 -80.19 -20.0 45.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.231 -0.655 . . . . 1.13 109.231 178.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 78.7 t -110.54 147.69 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 108.881 -0.785 . . . . 1.06 108.881 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.435 HG22 HD11 ' A' ' 53' ' ' ILE . 28.0 mm -100.1 120.51 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.2 -0.937 . . . . 1.04 109.325 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -98.38 126.97 44.11 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.168 -0.957 . . . . 0.13 110.393 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.477 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.1 mp -110.31 143.69 40.14 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 108.616 -0.883 . . . . 1.08 108.616 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -112.33 129.4 56.31 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 106.809 -1.552 . . . . 1.13 106.809 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.5 t -126.93 133.39 68.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.237 -0.914 . . . . 1.03 110.495 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -96.92 120.07 36.58 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.848 -0.797 . . . . 1.05 108.848 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.92 -18.88 24.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.592 -1.318 . . . . 1.04 107.739 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.2 m-20 -90.45 -43.89 9.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.504 -0.747 . . . . 1.08 111.599 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -95.75 -19.04 19.97 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.625 -1.297 . . . . 1.07 108.81 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -119.61 38.75 3.8 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.641 -1.244 . . . . 1.03 107.641 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -60.08 -22.56 62.89 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.835 -0.541 . . . . 1.92 109.933 -178.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.552 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.4 p30 -65.42 -38.32 89.57 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.76 -1.213 . . . . 1.05 108.84 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.552 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -71.41 -44.03 72.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 O-C-N 121.234 -0.916 . . . . 1.1 109.647 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.52 73.59 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.442 -0.787 . . . . 1.03 110.438 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -60.83 -34.0 73.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.922 -1.111 . . . . 0.89 109.446 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -62.47 -37.77 87.26 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.882 . . . . 2.06 109.184 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.25 0.02 57.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.347 -0.845 . . . . 1.05 110.929 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 mp0 53.61 49.85 18.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.946 -1.096 . . . . 2.02 109.025 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.08 134.18 29.12 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 O-C-N 121.0 -1.063 . . . . 1.05 108.441 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -105.44 -12.78 15.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.584 -0.698 . . . . 2.16 110.339 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.61 154.44 18.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.819 -1.176 . . . . 1.04 111.116 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -125.8 156.11 71.73 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.359 -1.349 . . . . 1.04 107.359 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -77.66 142.77 72.11 Favored 'Cis proline' 0 C--N 1.316 -1.17 0 C-N-CA 123.644 -1.399 . . . . 0.19 112.074 -2.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.9 134.04 48.11 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 109.245 -0.65 . . . . 1.04 109.245 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.535 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 90.9 m-85 -110.7 130.49 55.56 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.72 -0.845 . . . . 0.23 108.72 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -120.63 140.26 51.81 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.397 -0.964 . . . . 0.43 108.397 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -107.71 132.12 53.7 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.466 0.651 . . . . 0.17 110.388 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -125.79 144.11 50.78 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.803 -0.814 . . . . 0.17 108.803 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -147.07 128.51 14.96 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.208 -1.404 . . . . 2.18 107.208 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 mttt 60.01 28.03 17.51 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.129 -1.063 . . . . 1.8 108.129 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.19 21.66 75.32 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 110.133 -1.187 . . . . 0.23 110.133 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.404 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.5 mm100 -128.72 137.75 51.76 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.291 -1.123 . . . . 2.75 111.012 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -77.43 125.3 29.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.46 -0.775 . . . . 2.3 109.63 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -123.97 9.1 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.617 -0.677 . . . . 1.06 110.887 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.62 154.47 12.31 Favored Glycine 0 N--CA 1.496 2.695 0 C-N-CA 118.424 -1.846 . . . . 0.22 111.538 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -166.54 150.34 7.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.635 -0.921 . . . . 1.93 109.488 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.4 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 27.0 p90 -164.33 161.94 22.05 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.273 -0.971 . . . . 0.16 109.159 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -126.64 159.96 32.1 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.669 0.747 . . . . 0.9 109.539 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.09 142.85 6.38 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.897 -1.681 . . . . 0.12 108.897 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.98 67.86 4.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.151 -1.205 . . . . 1.04 110.142 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.51 97.19 5.53 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.417 -0.957 . . . . 1.36 108.417 178.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -35.43 77.4 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.098 -1.001 . . . . 1.6 111.335 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -61.81 -29.95 70.5 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.982 -1.074 . . . . 1.61 109.388 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -62.46 -33.61 75.16 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.75 -0.594 . . . . 2.02 109.404 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 38.5 mt -59.27 -39.72 83.8 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.974 -1.121 . . . . 1.05 107.974 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.88 -44.06 97.62 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.456 -0.898 . . . . 2.1 110.907 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.89 75.32 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.89 -1.131 . . . . 1.06 110.732 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -64.75 -40.59 95.55 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.833 -1.167 . . . . 1.04 109.015 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 77.6 mt -64.46 -47.85 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 N-CA-C 107.586 -1.264 . . . . 1.04 107.586 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -36.4 77.11 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.48 -0.933 . . . . 1.09 108.48 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -69.33 -40.23 77.71 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.684 -0.635 . . . . 2.21 110.483 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.2 mt -98.22 -2.91 38.61 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.245 -0.91 . . . . 1.05 111.554 -178.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.418 -1.426 . . . . 1.08 109.289 -179.804 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 108.754 -0.832 . . . . 1.89 108.754 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 31.6 mm -130.22 140.36 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 109.375 -0.602 . . . . 1.03 109.375 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.8 m -100.83 130.06 46.79 Favored 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 106.779 -1.563 . . . . 0.19 106.779 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.1 m -81.99 145.57 30.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.664 -1.272 . . . . 0.93 111.509 -177.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 24.7 m95 -80.0 -17.75 52.04 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.411 -0.806 . . . . 0.21 109.563 178.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.2 m120 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 108.176 -1.046 . . . . 0.49 108.176 179.626 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.1 tptp . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 108.916 -0.772 . . . . 2.18 108.916 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.423 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 66.3 tt0 -96.52 124.48 40.52 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.777 -1.194 . . . . 0.4 107.777 178.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.9 mm -102.03 115.06 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 1.04 108.893 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.423 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 30.9 mm-40 -99.17 -1.58 38.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.289 -0.882 . . . . 2.25 109.279 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 78.9 p -150.13 152.7 35.14 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.13 -0.981 . . . . 0.91 110.993 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' NZ ' ' CB ' ' A' ' 8' ' ' LYS . 2.9 ttmp? -62.83 -31.02 71.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.54 -0.911 . . . . 2.18 108.54 178.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.6 m -58.16 -48.62 79.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.106 -0.996 . . . . 1.03 109.495 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.06 70.56 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.257 -0.902 . . . . 1.02 108.872 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -59.79 -44.3 93.99 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.825 . . . . 0.15 109.183 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -65.6 -42.35 91.77 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.69 0.757 . . . . 2.07 109.166 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -64.23 -39.1 93.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.641 -0.662 . . . . 1.77 110.226 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.54 85.13 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.417 -0.802 . . . . 1.04 109.029 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.4 mt -60.62 -40.15 90.8 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.239 -0.985 . . . . 1.07 108.357 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -69.52 -36.7 76.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.235 -0.916 . . . . 1.07 109.872 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.95 -36.51 78.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.299 -0.876 . . . . 1.07 110.335 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.75 -33.59 75.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.263 -0.898 . . . . 1.03 109.383 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -124.58 20.44 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.345 -1.102 . . . . 0.24 110.345 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -92.52 3.12 56.12 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.124 -1.221 . . . . 1.07 110.83 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -75.14 150.74 38.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.106 -0.996 . . . . 2.03 108.767 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.484 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.38 155.54 24.93 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.823 -1.177 . . . . 1.23 107.823 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.484 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 46.8 t -142.84 113.17 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 121.128 -0.983 . . . . 1.03 108.695 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -102.08 140.97 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 107.908 -1.145 . . . . 1.03 107.908 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.98 123.68 67.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.351 -0.843 . . . . 1.01 109.572 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.529 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.4 t70 -100.62 109.25 21.31 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.573 -0.704 . . . . 1.05 110.922 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -91.0 101.28 14.05 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 106.575 -1.639 . . . . 0.73 106.575 176.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -128.14 146.48 50.69 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.326 -0.99 . . . . 0.84 108.326 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.95 123.63 30.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.164 -1.421 . . . . 1.04 107.164 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.0 -32.09 73.08 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 118.522 -1.271 . . . . 1.08 108.545 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.403 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 53.2 p-90 -70.57 -26.16 63.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.257 -0.902 . . . . 0.29 110.636 179.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -83.78 115.98 22.49 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.959 -1.088 . . . . 0.26 108.134 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.468 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -63.28 -50.05 65.85 Favored Glycine 0 N--CA 1.489 2.182 0 C-N-CA 120.622 -0.799 . . . . 0.28 111.713 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 38.6 Cg_exo -52.13 -35.88 64.17 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 CA-C-N 118.913 1.357 . . . . 0.5 111.98 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.81 -53.83 7.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.434 -0.792 . . . . 1.04 110.029 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ttpp -61.11 -37.21 81.96 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.06 -1.025 . . . . 2.12 109.867 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.497 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.6 tmm? -59.2 -28.17 66.41 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.569 -0.707 . . . . 2.66 109.878 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.442 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 72.9 mt -81.69 -3.86 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.838 -0.539 . . . . 1.22 111.332 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -64.88 -27.6 2.37 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 120.368 -1.458 . . . . 1.44 113.865 -178.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.2 Cg_exo -56.15 -40.69 83.23 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 CA-C-N 122.215 1.827 . . . . 0.31 112.604 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -67.92 -45.21 75.01 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 117.817 -1.553 . . . . 0.45 107.877 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -60.29 -53.43 57.79 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.255 -0.903 . . . . 0.16 110.177 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -68.23 -40.09 82.13 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.517 -0.739 . . . . 0.35 110.598 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 70.0 m -62.21 -38.96 91.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.093 -1.004 . . . . 0.77 110.096 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.13 -27.28 68.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.174 -0.954 . . . . 1.07 110.105 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.7 m -50.72 -38.48 47.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.864 -1.147 . . . . 0.87 109.424 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -83.3 -13.17 55.72 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.967 -1.083 . . . . 2.16 109.377 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 ttmp? -82.05 -36.91 27.22 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.705 -1.22 . . . . 2.29 107.705 178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -123.44 65.82 1.01 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 106.509 -1.663 . . . . 0.95 106.509 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.9 p -62.56 -8.87 7.12 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.154 -1.054 . . . . 0.89 108.154 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -89.9 8.44 32.18 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 1.13 108.48 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -127.27 148.93 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 107.698 -1.223 . . . . 1.06 107.698 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.9 mm -99.88 121.08 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.049 -1.032 . . . . 1.04 109.945 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -104.45 124.6 49.54 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.201 -0.937 . . . . 0.13 109.909 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.428 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.9 mp -110.5 143.62 40.58 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.952 -1.092 . . . . 1.08 109.833 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -112.8 130.05 56.22 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.74 -1.578 . . . . 1.13 106.74 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.08 140.43 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.916 0.865 . . . . 1.03 111.537 -177.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.414 ' O ' ' N ' ' A' ' 62' ' ' ALA . 58.3 t0 -102.7 118.07 36.03 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.633 -0.877 . . . . 1.05 108.633 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.0 m -69.73 -15.09 19.04 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 120.697 -1.252 . . . . 1.04 108.794 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.403 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.6 m-20 -95.42 -41.69 8.86 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.457 -0.777 . . . . 1.08 111.047 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -97.53 -18.66 18.85 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.072 -1.018 . . . . 1.07 108.552 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -122.66 39.15 4.0 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 107.223 -1.399 . . . . 1.03 107.223 178.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.708 HE21 ' H ' ' A' ' 64' ' ' ASP . 1.6 pm0 -60.16 -22.96 63.53 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.779 -0.646 . . . . 1.92 110.019 -178.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.708 ' H ' HE21 ' A' ' 63' ' ' GLN . 2.1 p30 -63.2 -36.21 82.87 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.943 -1.098 . . . . 1.05 109.202 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.526 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 13.8 t -73.64 -43.91 53.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.465 -0.772 . . . . 1.1 109.71 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.33 -39.06 68.47 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.768 -0.582 . . . . 1.03 111.309 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.3 p -60.21 -38.78 84.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.978 -1.076 . . . . 0.89 109.946 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.91 -36.5 84.13 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 2.06 109.206 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.03 -0.63 55.07 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.395 -0.816 . . . . 1.05 111.194 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.69 49.84 17.16 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.939 -1.101 . . . . 2.02 109.785 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.6 t -65.38 130.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 C-N-CA 118.329 -1.348 . . . . 1.05 108.276 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -102.15 -12.71 17.85 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.72 -0.613 . . . . 2.16 110.237 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.477 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.82 156.21 17.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.746 -1.221 . . . . 1.04 110.814 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 p -129.74 154.27 80.96 Favored Pre-proline 0 N--CA 1.504 2.23 0 N-CA-C 108.06 -1.089 . . . . 1.04 108.06 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -74.8 144.95 82.59 Favored 'Cis proline' 0 N--CA 1.496 1.665 0 C-N-CA 123.811 -1.329 . . . . 0.19 112.435 -2.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -130.33 136.12 48.79 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 108.57 -0.9 . . . . 1.04 108.57 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.529 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.5 m-85 -109.68 129.54 55.59 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.663 -0.648 . . . . 0.23 109.313 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -121.96 137.58 54.74 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.683 -0.858 . . . . 0.43 108.683 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -105.26 133.77 49.48 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.735 -0.603 . . . . 0.17 110.271 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -127.43 143.96 51.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.17 109.357 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -145.92 127.13 14.77 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 107.868 -1.16 . . . . 2.18 107.868 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.2 mttt 59.75 28.51 17.98 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.211 -1.033 . . . . 1.8 108.211 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.07 22.52 73.79 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.757 -1.337 . . . . 0.23 109.757 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -127.75 137.26 52.37 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.347 -1.09 . . . . 2.75 110.61 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -81.04 126.31 31.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.202 -0.936 . . . . 2.3 109.76 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.26 8.33 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.671 -0.643 . . . . 1.06 110.399 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.89 155.98 16.86 Favored Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.626 -1.749 . . . . 0.22 111.815 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -166.16 149.18 7.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.92 -0.753 . . . . 1.93 109.454 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.42 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 20.6 p90 -164.15 160.68 21.68 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.08 -1.048 . . . . 0.16 109.459 177.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -124.96 162.79 23.72 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.615 0.722 . . . . 0.9 109.86 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.55 137.57 5.53 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.135 -1.586 . . . . 0.12 109.135 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.02 67.78 2.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.179 -1.189 . . . . 1.04 110.232 -179.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -119.21 100.12 7.13 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.256 -1.016 . . . . 1.36 108.256 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.89 -34.7 73.89 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.492 -0.755 . . . . 1.6 112.36 -178.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.03 -29.89 71.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.538 -1.351 . . . . 1.61 109.553 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.83 -38.38 81.87 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.926 -0.768 . . . . 2.02 108.926 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.9 mt -57.76 -39.88 78.43 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.853 0.835 . . . . 1.05 108.929 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.81 -41.59 99.36 Favored 'General case' 0 C--N 1.293 -1.873 0 C-N-CA 119.825 -0.75 . . . . 2.1 110.611 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.01 77.28 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.106 -0.996 . . . . 1.06 111.861 -178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -39.58 93.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 120.544 -1.348 . . . . 1.04 109.67 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.5 mt -61.05 -49.9 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.101 -0.999 . . . . 1.04 108.818 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -60.18 -34.39 73.53 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.32 -0.992 . . . . 1.09 108.32 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -67.83 -38.5 83.28 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.696 -0.627 . . . . 2.21 109.752 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.5 mt -101.99 -0.13 34.23 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.299 -0.875 . . . . 1.05 111.56 -179.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.3 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 1.08 109.232 -179.172 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.1 mmtt . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.49 -0.559 . . . . 1.89 109.49 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 31.1 mm -130.25 140.47 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.865 -0.522 . . . . 1.03 110.057 -179.266 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 59.9 m -98.15 124.64 42.8 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 107.325 -1.361 . . . . 0.19 107.325 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 60.9 m -77.65 141.55 39.36 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.942 -1.098 . . . . 0.93 111.575 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 21.5 m95 -76.38 -9.57 58.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.21 109.274 178.911 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . 0.449 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.9 m120 . . . . . 0 N--CA 1.487 1.38 0 O-C-N 121.109 -0.994 . . . . 0.49 108.715 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.9 tptt . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 108.617 -0.883 . . . . 2.18 108.617 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -99.35 122.86 43.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.348 -0.845 . . . . 0.4 108.886 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.69 115.25 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.372 -0.83 . . . . 1.04 108.792 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.457 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 53.4 mp0 -97.52 -0.71 45.5 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.376 -0.827 . . . . 2.25 109.415 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -154.0 153.11 31.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.021 -1.049 . . . . 0.91 111.198 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.84 -32.4 73.61 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.445 -0.946 . . . . 2.18 108.445 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.3 m -58.96 -46.44 88.06 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.999 -1.111 . . . . 1.03 107.999 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.92 -30.7 69.22 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.634 -0.876 . . . . 1.02 108.634 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -59.83 -43.79 94.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.109 -0.994 . . . . 0.15 108.964 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -65.36 -41.29 94.0 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.831 -0.803 . . . . 2.07 108.831 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.9 -35.34 79.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.663 -0.648 . . . . 1.77 110.237 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.81 82.92 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.284 -0.885 . . . . 1.04 109.234 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.3 mt -61.52 -40.39 94.45 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.334 -0.854 . . . . 1.07 108.807 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -70.05 -36.83 75.29 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.417 -0.802 . . . . 1.07 110.185 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.11 90.14 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.361 -0.837 . . . . 1.07 110.338 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -32.66 71.52 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.381 -0.824 . . . . 1.03 109.847 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.08 -126.8 23.75 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.31 -1.116 . . . . 0.24 110.31 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -91.75 5.27 50.45 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.892 -1.358 . . . . 1.07 110.978 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -77.58 151.83 34.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.128 -0.983 . . . . 2.03 109.469 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.453 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.03 156.91 16.76 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.489 -1.3 . . . . 1.23 107.489 179.78 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.453 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 77.8 t -143.75 117.99 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.856 -1.153 . . . . 1.03 108.859 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.0 142.08 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 107.813 -1.18 . . . . 1.03 107.813 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.45 123.76 66.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.351 -0.843 . . . . 1.01 109.205 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.473 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.1 t70 -100.82 118.1 36.22 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.473 -0.767 . . . . 1.05 109.633 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -95.18 22.8 6.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.306 -0.871 . . . . 0.73 109.902 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.3 m -59.04 148.01 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.027 -1.045 . . . . 0.84 110.779 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.13 123.82 32.6 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.074 -1.084 . . . . 1.04 108.074 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.0 t -65.26 -34.51 78.52 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 118.916 -1.114 . . . . 1.08 108.192 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.543 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 57.0 p-90 -70.12 -23.28 63.0 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.218 -0.927 . . . . 0.29 111.003 179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.2 t -82.68 112.89 19.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.734 -1.229 . . . . 0.26 107.992 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.455 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.85 -50.58 66.17 Favored Glycine 0 N--CA 1.489 2.211 0 C-N-CA 120.329 -0.939 . . . . 0.28 111.246 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.1 Cg_exo -51.45 -37.82 62.51 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 CA-C-N 119.011 1.406 . . . . 0.5 111.958 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.49 -47.5 19.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.057 -1.027 . . . . 1.04 109.909 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.54 -31.52 69.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.135 -0.978 . . . . 2.12 109.127 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.511 ' O ' ' SD ' ' A' ' 37' ' ' MET . 1.2 tmt? -59.91 -29.74 68.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.473 -0.767 . . . . 2.66 109.967 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.5 mt -80.78 -5.07 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.523 -0.736 . . . . 1.22 111.325 -179.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.526 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.28 -31.52 9.36 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 119.988 -1.695 . . . . 1.44 113.669 -176.857 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -59.9 -37.46 85.66 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 CA-C-N 121.898 1.714 . . . . 0.31 112.067 -178.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -71.62 -51.4 23.41 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 118.371 -1.332 . . . . 0.45 108.175 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.87 -46.7 88.46 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.38 -0.825 . . . . 0.16 109.039 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.14 -45.65 73.02 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.493 -0.755 . . . . 0.35 110.846 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.7 m -61.62 -39.92 93.0 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.085 -1.009 . . . . 0.77 111.154 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.6 mt -61.33 -22.31 64.79 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.269 -0.894 . . . . 1.07 110.852 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -55.51 -38.25 68.96 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 120.981 -1.074 . . . . 0.87 108.714 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -86.21 -16.66 37.03 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.251 -0.905 . . . . 2.16 109.263 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -76.58 -35.75 57.96 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.325 -1.361 . . . . 2.29 107.325 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -123.9 67.92 1.04 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 107.552 -1.277 . . . . 0.95 107.552 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.7 p -64.06 -7.73 9.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.578 -0.897 . . . . 0.89 108.578 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -89.16 5.48 44.46 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.115 -1.069 . . . . 1.13 108.115 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.4 t -128.0 143.08 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 N-CA-C 107.605 -1.257 . . . . 1.06 107.605 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.5 mm -99.21 122.55 51.1 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.913 -1.117 . . . . 1.04 109.203 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -100.76 129.01 46.59 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.298 -0.876 . . . . 0.13 109.219 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.452 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.3 mp -112.52 141.52 46.19 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.357 -0.839 . . . . 1.08 109.138 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -109.94 132.62 53.99 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.673 -1.603 . . . . 1.13 106.673 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -130.45 132.0 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.27 -0.894 . . . . 1.03 110.26 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 62' ' ' ALA . 57.6 t0 -95.64 120.96 36.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 1.05 108.52 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.87 -20.52 26.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 120.659 -1.276 . . . . 1.04 107.989 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.543 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.1 m-20 -90.25 -43.2 10.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.618 -0.676 . . . . 1.08 111.506 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -95.75 -14.2 23.54 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.561 -1.337 . . . . 1.07 108.237 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 39.72 3.9 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.21 -1.404 . . . . 1.03 107.21 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -60.08 -26.93 66.58 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.628 -0.67 . . . . 1.92 109.362 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.499 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.33 -37.48 87.21 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.029 -1.044 . . . . 1.05 108.969 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.499 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 7.6 t -70.28 -47.26 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.236 -0.915 . . . . 1.1 109.797 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.33 -36.92 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.446 -0.784 . . . . 1.03 110.788 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -61.07 -32.59 72.23 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.027 -1.046 . . . . 0.89 109.57 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.9 -35.73 80.68 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.246 -0.908 . . . . 2.06 109.283 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.02 -0.22 56.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.281 -0.887 . . . . 1.05 110.857 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 54.62 50.06 16.77 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.056 -1.027 . . . . 2.02 109.954 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.2 t -67.45 132.38 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 120.938 -1.101 . . . . 1.05 108.731 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -104.6 -12.63 16.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.671 -0.643 . . . . 2.16 110.66 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.8 153.42 16.77 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.499 -1.376 . . . . 1.04 110.841 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -124.84 155.26 70.43 Favored Pre-proline 0 N--CA 1.501 2.122 0 N-CA-C 108.038 -1.097 . . . . 1.04 108.038 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -76.44 143.16 75.38 Favored 'Cis proline' 0 N--CA 1.493 1.457 0 C-N-CA 123.844 -1.315 . . . . 0.19 112.538 -2.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.9 m -128.97 136.12 49.92 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.11 -0.7 . . . . 1.04 109.11 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.473 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.8 m-85 -112.01 129.64 56.13 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.778 -0.823 . . . . 0.23 108.778 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -121.49 137.75 54.59 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.843 -1.169 . . . . 0.43 107.843 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -105.56 134.59 48.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.722 -0.611 . . . . 0.17 110.978 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -128.1 148.99 50.6 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.47 0.653 . . . . 0.17 109.546 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.546 ' HZ1' ' NZ ' ' A' ' 82' ' ' LYS . 54.4 tttm -150.74 125.62 9.79 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.74 -1.207 . . . . 2.18 107.74 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.546 ' NZ ' ' HZ1' ' A' ' 81' ' ' LYS . 55.1 mttp 60.03 28.17 17.68 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 108.956 -0.757 . . . . 1.8 108.956 -178.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.2 21.46 70.38 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.113 -1.195 . . . . 0.23 110.113 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -129.51 140.21 51.32 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.328 -1.101 . . . . 2.75 110.596 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -77.79 129.12 35.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.551 -0.718 . . . . 2.3 109.063 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.4 m -123.24 8.03 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.683 -0.636 . . . . 1.06 110.39 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.81 14.6 Favored Glycine 0 N--CA 1.497 2.704 0 C-N-CA 118.433 -1.842 . . . . 0.22 112.059 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -164.13 149.44 10.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 122.005 -0.703 . . . . 1.93 109.87 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 8.2 p90 -163.81 159.57 21.37 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.389 -0.82 . . . . 0.16 109.967 177.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.4 p -126.2 160.46 30.2 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.867 0.842 . . . . 0.9 110.253 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.34 140.78 5.6 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.652 -1.779 . . . . 0.12 108.652 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.32 62.91 3.8 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.184 -1.186 . . . . 1.04 110.193 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.4 t-20 -117.48 101.82 8.69 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.89 -1.152 . . . . 1.36 107.89 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -31.45 69.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.484 -0.76 . . . . 1.6 111.747 -178.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.94 -29.56 69.46 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.721 -1.237 . . . . 1.61 109.551 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.429 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 74.4 tttt -60.07 -34.09 72.97 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 108.353 -0.98 . . . . 2.02 108.353 -179.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.1 mt -59.87 -40.04 87.3 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.61 -0.885 . . . . 1.05 108.61 179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -63.09 -42.4 99.61 Favored 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.916 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.55 78.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.185 -0.947 . . . . 1.06 111.278 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.04 -39.31 90.06 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 120.753 -1.217 . . . . 1.04 109.873 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.4 mt -61.38 -47.49 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.001 -1.062 . . . . 1.04 108.511 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -60.41 -35.63 76.24 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 121.821 0.82 . . . . 1.09 108.922 178.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.29 -39.72 86.01 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.75 -0.594 . . . . 2.21 109.886 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 73.4 mt -99.35 -2.65 35.78 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.236 -0.915 . . . . 1.05 111.046 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.521 -1.362 . . . . 1.08 109.019 -179.373 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.283 -0.636 . . . . 1.89 109.283 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 33.1 mm -129.29 140.1 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 121.813 -0.555 . . . . 1.03 109.821 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.6 m -101.64 132.15 47.47 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.725 -1.213 . . . . 0.19 107.725 178.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.0 m -81.66 141.55 33.54 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.726 -1.234 . . . . 0.93 110.994 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.427 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.6 m95 -76.21 -12.55 60.11 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.292 -0.88 . . . . 0.21 108.904 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--N 1.303 -1.43 0 N-CA-C 108.36 -0.978 . . . . 0.49 108.36 179.61 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.4 tptt . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 107.83 -1.174 . . . . 2.18 107.83 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -96.55 122.62 39.66 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.847 -0.798 . . . . 0.4 108.847 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.9 111.95 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 108.487 -0.931 . . . . 1.04 108.487 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.458 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.9 mp0 -95.65 -0.44 51.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.138 -0.976 . . . . 2.25 109.844 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.412 ' HG ' ' H ' ' A' ' 10' ' ' ALA . 80.4 p -155.58 156.3 34.85 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.79 -1.194 . . . . 0.91 111.782 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -61.87 -31.7 71.99 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.225 -1.028 . . . . 2.18 108.225 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.408 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 60.0 m -58.51 -49.91 75.67 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.503 -0.879 . . . . 1.03 108.818 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.412 ' H ' ' HG ' ' A' ' 7' ' ' SER . . . -68.43 -29.03 67.59 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.933 -0.766 . . . . 1.02 108.933 179.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.75 -44.52 93.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 0.15 109.351 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -65.01 -44.02 90.56 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.424 -0.797 . . . . 2.07 109.305 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.533 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.84 -39.45 94.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.704 -0.623 . . . . 1.77 110.414 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.19 95.36 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.374 -0.829 . . . . 1.04 109.057 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.6 mt -60.25 -41.06 92.42 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.315 -0.866 . . . . 1.07 109.011 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -70.02 -36.16 74.87 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.359 -0.838 . . . . 1.07 110.474 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.46 78.71 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.132 -0.98 . . . . 1.07 110.965 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.62 -31.48 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.897 -1.127 . . . . 1.03 109.675 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.95 -124.67 20.83 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.989 -1.244 . . . . 0.24 109.989 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.462 ' CG ' ' HZ2' ' A' ' 82' ' ' LYS . 65.2 m-20 -91.85 0.33 57.49 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.999 -1.294 . . . . 1.07 110.706 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -74.78 150.1 39.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.838 -1.164 . . . . 2.03 109.646 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.2 mt -57.39 159.94 4.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.961 -1.087 . . . . 1.23 109.316 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.1 t -146.65 107.92 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 108.102 -1.073 . . . . 1.03 108.102 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.6 t -102.46 136.26 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 N-CA-C 107.595 -1.261 . . . . 1.03 107.595 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.9 t -118.18 123.05 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.201 -0.937 . . . . 1.01 109.742 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -98.97 119.78 38.31 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 1.05 109.928 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -97.85 24.91 6.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.23 -0.919 . . . . 0.73 110.401 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -59.88 148.26 35.49 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.036 -1.04 . . . . 0.84 110.403 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.39 124.54 32.11 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.687 -1.227 . . . . 1.04 107.687 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.09 -33.61 74.86 Favored 'General case' 0 C--N 1.298 -1.638 0 C-N-CA 118.877 -1.129 . . . . 1.08 108.703 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.538 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 53.4 p-90 -69.95 -21.63 63.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.147 -0.971 . . . . 0.29 110.447 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.1 t -84.59 112.01 20.04 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.974 -1.079 . . . . 0.26 108.342 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.431 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.92 -52.05 55.57 Favored Glycine 0 N--CA 1.491 2.349 0 C-N-CA 120.862 -0.685 . . . . 0.28 111.64 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -51.23 -35.28 52.21 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 CA-C-N 119.062 1.431 . . . . 0.5 111.72 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.66 17.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.587 -0.696 . . . . 1.04 109.816 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.0 -32.15 70.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.28 -0.887 . . . . 2.12 109.533 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 19.1 ttt -59.81 -27.76 66.87 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 2.66 108.998 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.5 mt -82.2 -7.72 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.782 -0.574 . . . . 1.22 111.868 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.93 -31.13 8.6 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 119.858 -1.776 . . . . 1.44 114.168 -177.472 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.9 Cg_exo -58.61 -38.61 88.63 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.616 1.613 . . . . 0.31 112.579 -178.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -69.29 -51.07 40.9 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 118.773 -1.171 . . . . 0.45 108.954 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.63 -50.81 72.44 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.248 -0.908 . . . . 0.16 109.508 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -67.47 -44.24 79.07 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.744 -0.597 . . . . 0.35 111.522 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.5 -37.1 84.73 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.953 -1.092 . . . . 0.77 110.496 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.73 -25.42 67.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 1.07 110.315 -178.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.0 m -51.62 -38.35 54.27 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.075 -1.016 . . . . 0.87 108.633 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -85.87 -17.03 36.72 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.4 -0.812 . . . . 2.16 109.415 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -77.66 -37.34 50.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 107.594 -1.261 . . . . 2.29 107.594 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -121.85 67.25 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 106.699 -1.593 . . . . 0.95 106.699 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.5 p -63.44 -10.1 15.74 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.856 -0.794 . . . . 0.89 108.856 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -90.99 8.84 33.26 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.6 -0.889 . . . . 1.13 108.6 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 70.0 t -127.12 145.72 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 107.406 -1.331 . . . . 1.06 107.406 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.428 HG22 HD11 ' A' ' 53' ' ' ILE . 26.1 mm -100.31 120.61 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 120.978 -1.076 . . . . 1.04 109.989 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -102.96 127.78 50.05 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.006 -1.059 . . . . 0.13 109.891 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.425 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.2 mp -110.06 141.4 42.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.984 -1.073 . . . . 1.08 109.489 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -110.14 132.88 53.77 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.316 -1.364 . . . . 1.13 107.316 178.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 39.6 t -130.23 131.92 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.157 -0.964 . . . . 1.03 110.839 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -95.2 119.97 34.62 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.135 -1.061 . . . . 1.05 108.135 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.11 -20.1 25.37 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 C-N-CA 118.749 -1.181 . . . . 1.04 108.532 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.9 m-20 -91.72 -41.36 10.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.486 -0.759 . . . . 1.08 111.806 -178.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -95.91 -14.78 22.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 120.408 -1.433 . . . . 1.07 108.236 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.98 38.9 4.09 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.601 -1.259 . . . . 1.03 107.601 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -59.84 -26.58 65.92 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 109.414 -0.587 . . . . 1.92 109.414 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.12 -36.29 83.56 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.804 -1.185 . . . . 1.05 109.495 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.461 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.2 t -73.26 -43.12 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 120.961 -1.087 . . . . 1.1 109.694 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.9 -37.83 67.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.379 -0.826 . . . . 1.03 110.394 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 84.8 p -60.99 -33.91 73.98 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.09 -1.007 . . . . 0.89 108.467 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -60.64 -40.02 90.41 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.538 -0.726 . . . . 2.06 109.056 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.18 4.58 50.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.331 -0.856 . . . . 1.05 110.869 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 52.25 50.13 19.06 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.884 -1.135 . . . . 2.02 110.545 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.35 132.13 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.778 -1.201 . . . . 1.05 108.87 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -103.92 -9.89 18.58 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.719 -0.613 . . . . 2.16 109.611 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.477 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.45 155.79 20.33 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.772 -1.205 . . . . 1.04 111.772 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -126.04 154.3 73.98 Favored Pre-proline 0 N--CA 1.499 1.976 0 N-CA-C 107.566 -1.272 . . . . 1.04 107.566 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -78.86 140.06 56.93 Favored 'Cis proline' 0 N--CA 1.487 1.144 0 C-N-CA 123.657 -1.393 . . . . 0.19 111.97 -2.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -124.22 132.89 53.63 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.885 -0.783 . . . . 1.04 108.885 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.524 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.6 m-85 -110.67 131.48 55.01 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.938 -0.764 . . . . 0.23 108.938 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -121.63 140.4 52.31 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.605 -0.887 . . . . 0.43 108.605 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -107.87 131.15 54.8 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.397 0.617 . . . . 0.17 109.679 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -125.62 148.98 48.78 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 109.082 -0.71 . . . . 0.17 109.082 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -147.31 127.74 14.03 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.182 -1.414 . . . . 2.18 107.182 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.462 ' HZ2' ' CG ' ' A' ' 20' ' ' ASP . 40.4 mttm 56.09 33.26 21.62 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.057 -1.027 . . . . 1.8 108.89 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.56 24.72 76.45 Favored Glycine 0 N--CA 1.484 1.883 0 N-CA-C 109.82 -1.312 . . . . 0.23 109.82 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.1 mm100 -129.23 135.92 49.43 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.513 -0.993 . . . . 2.75 110.809 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -73.69 129.99 39.07 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.093 -1.004 . . . . 2.3 109.651 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.0 10.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.864 -0.523 . . . . 1.06 110.09 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 164.01 161.78 13.77 Favored Glycine 0 N--CA 1.496 2.658 0 C-N-CA 118.373 -1.87 . . . . 0.22 112.051 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -165.25 154.65 12.65 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.872 -0.781 . . . . 1.93 109.325 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 5.8 p90 -166.92 157.03 11.38 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.886 -0.726 . . . . 0.16 109.355 178.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -125.54 160.91 28.38 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.608 -0.682 . . . . 0.9 109.418 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.7 143.34 6.11 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.532 -1.827 . . . . 0.12 108.532 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.15 64.04 4.85 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.171 -1.193 . . . . 1.04 109.146 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.83 98.4 6.48 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 108.336 -0.987 . . . . 1.36 108.336 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -34.77 72.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.448 -0.782 . . . . 1.6 111.312 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -62.57 -29.37 70.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.206 -0.934 . . . . 1.61 109.257 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -60.9 -37.62 82.87 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.603 -0.686 . . . . 2.02 109.149 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.05 -39.79 83.11 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.232 -1.025 . . . . 1.05 108.232 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.37 -44.01 96.02 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.051 -0.66 . . . . 2.1 110.503 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.64 -44.08 62.37 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.966 -1.084 . . . . 1.06 111.318 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.4 m -63.2 -40.03 96.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.644 -1.285 . . . . 1.04 109.739 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 69.2 mt -62.1 -50.09 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.221 -0.924 . . . . 1.04 108.551 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -60.87 -34.35 74.48 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 122.023 0.916 . . . . 1.09 108.758 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -67.61 -39.87 84.74 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.525 -0.734 . . . . 2.21 110.208 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 75.8 mt -101.3 -3.13 29.46 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.019 -1.051 . . . . 1.05 111.493 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.5 2.036 0 O-C-N 120.392 -1.442 . . . . 1.08 109.678 -179.021 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.541 -0.54 . . . . 1.89 109.541 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.9 mm -130.0 140.78 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 N-CA-C 109.592 -0.521 . . . . 1.03 109.592 -179.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 16.9 m -101.61 129.49 47.74 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 107.159 -1.423 . . . . 0.19 107.159 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.5 m -81.15 143.93 32.03 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.887 -1.133 . . . . 0.93 111.802 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.477 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 27.6 m95 -76.79 -10.92 59.71 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.052 -1.03 . . . . 0.21 109.24 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 108.625 -0.88 . . . . 0.49 108.625 179.821 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.418 -0.956 . . . . 2.18 108.418 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -94.91 125.31 39.49 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.166 -0.959 . . . . 0.4 109.265 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.4 mm -100.56 116.36 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.404 -0.961 . . . . 1.04 108.404 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -99.64 -2.8 34.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.396 -0.815 . . . . 2.25 109.433 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -152.57 155.99 38.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 119.257 -0.977 . . . . 0.91 111.189 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -62.33 -33.81 75.42 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.924 -1.139 . . . . 2.18 107.924 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.2 m -56.0 -49.39 73.77 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 118.962 -1.095 . . . . 1.03 108.96 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.24 69.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.665 -0.865 . . . . 1.02 108.665 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -59.77 -43.14 94.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.023 -1.048 . . . . 0.15 109.069 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -65.49 -41.61 93.08 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 108.33 -0.989 . . . . 2.07 108.33 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -66.57 -35.73 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.785 -0.572 . . . . 1.77 109.941 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.919 . . . . 1.04 108.746 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.3 mt -61.37 -42.66 99.07 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.419 -0.956 . . . . 1.07 108.419 179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -68.49 -37.08 79.79 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.622 -0.674 . . . . 1.07 110.053 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.61 -38.63 84.22 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.336 -0.852 . . . . 1.07 109.64 -179.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.82 69.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.119 -0.988 . . . . 1.03 110.331 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -128.05 26.05 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.276 -1.13 . . . . 0.24 110.276 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -91.65 3.48 54.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.141 -1.211 . . . . 1.07 109.957 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.4 mttp -75.16 149.16 39.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.022 -1.048 . . . . 2.03 109.44 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.451 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.08 154.9 18.23 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.752 -1.203 . . . . 1.23 107.752 -179.637 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.451 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 92.5 t -142.57 109.75 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.996 -1.065 . . . . 1.03 108.99 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.3 t -100.12 141.16 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 107.783 -1.191 . . . . 1.03 107.783 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -123.42 121.69 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 O-C-N 120.893 -1.13 . . . . 1.01 109.978 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.563 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.55 121.72 40.85 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.359 -0.838 . . . . 1.05 110.11 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -97.13 21.36 9.97 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.126 -0.984 . . . . 0.73 110.226 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.42 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 52.3 m -54.16 147.06 13.65 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.045 -1.034 . . . . 0.84 111.306 -178.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.94 126.19 33.3 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.843 -1.169 . . . . 1.04 107.843 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.8 t -66.93 -36.56 82.52 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.646 -1.284 . . . . 1.08 108.477 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 57.3 p-90 -69.9 -22.6 63.21 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.333 -0.854 . . . . 0.29 111.761 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.9 t -83.77 118.39 23.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.715 -1.241 . . . . 0.26 108.806 -179.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.06 -54.39 37.14 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 120.1 -1.048 . . . . 0.28 111.074 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -50.69 -38.58 56.21 Favored 'Trans proline' 0 C--N 1.309 -1.549 0 CA-C-N 119.074 1.437 . . . . 0.5 111.95 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.72 -49.96 19.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 1.04 110.504 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -60.42 -38.12 83.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.091 -1.006 . . . . 2.12 109.391 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 22.5 ttt -57.42 -28.61 63.43 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.477 -0.765 . . . . 2.66 110.183 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 63.6 mt -85.18 -2.81 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.829 -0.544 . . . . 1.22 111.047 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.572 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 3.4 ptmt -64.16 -29.54 3.99 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 120.111 -1.618 . . . . 1.44 112.979 -178.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.0 Cg_exo -56.62 -41.67 73.4 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 121.525 1.581 . . . . 0.31 113.116 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.61 ' CE1' ' NZ ' ' A' ' 94' ' ' LYS . 31.3 m-85 -68.15 -44.7 75.43 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.249 -1.532 . . . . 0.45 108.575 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -61.14 -53.9 51.19 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.79 0.805 . . . . 0.16 110.342 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -68.24 -42.27 79.97 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.77 -0.582 . . . . 0.35 111.404 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.492 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.4 m -60.52 -37.76 82.2 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.102 -0.999 . . . . 0.77 110.692 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 mt -63.15 -21.74 66.4 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.84 -1.163 . . . . 1.07 110.792 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.0 m -51.56 -39.43 57.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.613 -1.304 . . . . 0.87 108.916 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -82.46 -16.5 48.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.434 -0.791 . . . . 2.16 109.598 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -78.28 -36.68 46.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.091 -1.448 . . . . 2.29 107.091 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -124.18 67.85 1.06 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 107.353 -1.351 . . . . 0.95 107.353 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -63.86 -10.44 20.6 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.574 -0.899 . . . . 0.89 108.574 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -89.25 6.16 41.55 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.349 -0.982 . . . . 1.13 108.349 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 43.4 t -126.07 143.67 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 N-CA-C 107.289 -1.374 . . . . 1.06 107.289 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.448 HD11 HG22 ' A' ' 53' ' ' ILE . 32.6 mm -99.89 120.35 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 121.043 -1.036 . . . . 1.04 110.0 -178.199 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -100.83 128.64 46.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.157 -0.965 . . . . 0.13 109.496 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 2.8 mp -110.34 140.01 44.97 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 120.945 -1.097 . . . . 1.08 109.771 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -110.1 132.01 54.54 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.777 -1.564 . . . . 1.13 106.777 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -130.13 130.19 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.06 -1.025 . . . . 1.03 110.437 -178.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -93.0 121.07 33.96 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.27 -1.011 . . . . 1.05 108.27 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -68.37 -19.0 23.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.689 -1.257 . . . . 1.04 108.362 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.2 m-20 -92.66 -39.83 11.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.45 -0.781 . . . . 1.08 112.126 -179.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -98.02 -14.39 20.57 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.708 -1.245 . . . . 1.07 108.199 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -126.83 39.32 3.94 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 107.586 -1.264 . . . . 1.03 107.586 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -59.79 -23.18 63.07 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 115.748 -0.66 . . . . 1.92 110.097 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.36 -39.99 94.97 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.94 -1.1 . . . . 1.05 109.177 179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.539 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -69.54 -45.13 78.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 O-C-N 121.125 -0.985 . . . . 1.1 110.108 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.35 69.75 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.623 -0.673 . . . . 1.03 110.699 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.3 p -60.31 -39.43 86.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.936 -1.103 . . . . 0.89 109.981 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -62.88 -37.08 85.48 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.148 -0.97 . . . . 2.06 109.336 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.64 0.49 50.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.149 -0.97 . . . . 1.05 110.248 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 52.28 50.25 18.79 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.868 -1.145 . . . . 2.02 109.375 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 35.3 t -64.17 134.57 28.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 120.46 -1.4 . . . . 1.05 108.138 -179.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -106.51 -12.38 15.63 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.501 -0.749 . . . . 2.16 109.987 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.49 155.02 21.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.96 -1.088 . . . . 1.04 110.378 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.62 155.72 80.8 Favored Pre-proline 0 N--CA 1.506 2.361 0 N-CA-C 107.596 -1.261 . . . . 1.04 107.596 178.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -73.03 142.87 76.08 Favored 'Cis proline' 0 N--CA 1.495 1.615 0 CA-C-N 120.22 1.114 . . . . 0.19 112.759 -2.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 89.8 m -130.1 129.97 44.24 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.511 -0.922 . . . . 1.04 108.511 178.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.563 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.8 m-85 -106.94 130.32 54.62 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.23 109.741 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -122.07 139.88 53.19 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.162 -0.961 . . . . 0.43 109.256 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -105.82 137.76 43.15 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.496 0.665 . . . . 0.17 110.448 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.82 150.27 52.06 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.82 -0.807 . . . . 0.17 108.82 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -147.16 129.37 15.64 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.562 -1.273 . . . . 2.18 107.562 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.7 mttt 52.0 32.26 9.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.836 -1.165 . . . . 1.8 109.04 -178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.83 21.65 76.15 Favored Glycine 0 N--CA 1.483 1.811 0 N-CA-C 110.452 -1.059 . . . . 0.23 110.452 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -127.87 142.48 51.26 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.298 -1.119 . . . . 2.75 110.26 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -76.84 127.34 32.56 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.46 -0.775 . . . . 2.3 109.456 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -121.35 1.56 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.562 -0.711 . . . . 1.06 110.442 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.92 163.69 31.02 Favored Glycine 0 N--CA 1.5 2.903 0 C-N-CA 118.701 -1.714 . . . . 0.22 111.57 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.486 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.4 tp10 -166.7 149.97 6.88 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.53 -0.983 . . . . 1.93 109.178 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.486 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.6 p90 -168.76 157.72 8.56 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.084 -1.01 . . . . 0.16 109.794 177.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -126.76 164.51 21.18 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.602 -0.687 . . . . 0.9 109.736 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.37 145.26 8.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.849 -1.301 . . . . 0.12 109.849 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.77 68.04 4.65 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.552 -0.97 . . . . 1.04 109.524 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.477 ' ND2' ' OE1' ' A' ' 95' ' ' GLU . 0.7 OUTLIER -119.15 91.69 3.62 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 108.334 -0.988 . . . . 1.36 108.334 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.61 ' NZ ' ' CE1' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -67.27 -30.98 71.01 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.636 -0.665 . . . . 1.6 111.55 -178.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . 0.477 ' OE1' ' ND2' ' A' ' 93' ' ' ASN . 55.2 mp0 -67.42 -30.12 69.78 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.809 -1.182 . . . . 1.61 109.144 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.35 -35.26 75.25 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.268 -0.895 . . . . 2.02 108.762 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.1 mt -59.56 -38.96 82.5 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.904 0.859 . . . . 1.05 108.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -62.83 -43.38 98.94 Favored 'General case' 0 C--N 1.294 -1.816 0 C-N-CA 119.997 -0.681 . . . . 2.1 111.043 -178.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -43.8 70.7 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.114 -0.991 . . . . 1.06 112.032 -178.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -63.18 -39.5 94.83 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.943 -1.098 . . . . 1.04 109.996 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.417 ' O ' ' N ' ' A' ' 105' ' ' VAL . 49.4 mt -62.89 -49.19 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 120.984 -1.073 . . . . 1.04 108.391 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.86 -36.62 77.25 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.84 -1.17 . . . . 1.09 107.84 179.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -67.17 -39.54 86.47 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.62 -0.675 . . . . 2.21 109.718 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -100.82 0.57 38.91 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.839 -1.163 . . . . 1.05 111.683 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' A' ' 101' ' ' ILE . 7.9 p . . . . . 0 N--CA 1.497 1.892 0 O-C-N 120.191 -1.568 . . . . 1.08 109.395 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.669 0.271 . . . . 1.89 110.331 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 31.2 mm -130.51 142.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 N-CA-C 109.728 -0.471 . . . . 1.03 109.728 -179.166 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.4 m -97.69 129.55 44.74 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.635 -1.617 . . . . 0.19 106.635 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -79.53 139.86 37.42 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.894 -1.129 . . . . 0.93 111.307 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -74.42 -11.51 60.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.674 -0.641 . . . . 0.21 109.273 178.923 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . 0.407 ' N ' HD21 ' B' ' 68' ' ' ASN . 2.1 m120 . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.399 -0.813 . . . . 0.49 109.033 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 tptt . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 108.546 -0.909 . . . . 2.18 108.546 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -96.45 124.01 40.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.201 -0.937 . . . . 0.4 108.653 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.433 HG22 HD11 ' A' ' 5' ' ' ILE . 29.2 mm -100.73 113.78 37.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 N-CA-C 108.364 -0.976 . . . . 1.04 108.364 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.74 -3.7 32.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.278 -0.889 . . . . 2.25 109.321 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -152.49 155.9 38.37 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.22 -0.925 . . . . 0.91 110.612 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -64.59 -31.84 73.23 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.349 -0.982 . . . . 2.18 108.349 178.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.7 m -55.64 -47.87 75.91 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.416 -0.913 . . . . 1.03 109.018 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.08 -30.24 69.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.427 -0.796 . . . . 1.02 109.177 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -59.69 -45.23 92.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.189 -0.944 . . . . 0.15 109.237 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -63.87 -41.41 97.76 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 108.89 -0.781 . . . . 2.07 108.89 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.98 -37.21 86.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.677 -0.639 . . . . 1.77 110.006 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.45 80.32 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.369 -0.832 . . . . 1.04 109.42 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.21 -40.12 88.99 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.444 -0.947 . . . . 1.07 108.444 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.83 -34.77 74.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.625 -0.672 . . . . 1.07 109.925 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.7 85.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.283 -0.886 . . . . 1.07 109.91 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.47 -31.87 71.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.246 -0.909 . . . . 1.03 109.999 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.49 18.38 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.687 -1.365 . . . . 0.24 109.687 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.541 ' OD1' ' NZ ' ' A' ' 82' ' ' LYS . 62.9 m-20 -91.77 2.52 56.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -1.102 . . . . 1.07 110.374 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -76.02 149.16 37.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.98 -1.075 . . . . 2.03 109.593 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.492 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.84 159.57 8.81 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.487 -1.301 . . . . 1.23 107.487 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.492 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 96.1 t -146.9 109.94 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 O-C-N 120.823 -1.173 . . . . 1.03 108.82 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.7 t -98.27 142.27 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 N-CA-C 107.971 -1.122 . . . . 1.03 107.971 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.96 121.0 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.455 -0.778 . . . . 1.01 109.488 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.552 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.9 t70 -98.67 119.74 37.92 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.395 -0.816 . . . . 1.05 110.404 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -96.18 21.67 8.61 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.456 -0.777 . . . . 0.73 109.743 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -57.29 145.01 33.47 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.978 -1.076 . . . . 0.84 109.945 -178.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.9 127.43 33.5 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.678 -1.23 . . . . 1.04 107.678 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -68.59 -31.7 71.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.827 -1.149 . . . . 1.08 108.822 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.513 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 60.6 p-90 -73.22 -20.81 60.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.066 -1.021 . . . . 0.29 110.838 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.6 t -81.88 122.64 28.0 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.834 -1.166 . . . . 0.26 108.54 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.461 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.42 -54.04 34.86 Favored Glycine 0 N--CA 1.489 2.175 0 C-N-CA 120.748 -0.739 . . . . 0.28 111.822 -178.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.2 Cg_endo -60.56 -30.0 89.71 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 CA-C-N 119.398 1.599 . . . . 0.5 112.533 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.39 -54.19 6.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.072 -1.017 . . . . 1.04 109.695 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -61.35 -38.15 85.91 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.305 -0.872 . . . . 2.12 109.673 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.44 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 35.5 ttm -59.88 -28.17 67.31 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.46 -0.775 . . . . 2.66 109.529 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.431 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 66.4 mt -80.94 -4.41 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.847 -0.533 . . . . 1.22 110.735 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.546 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.2 ptmt -64.36 -26.07 1.79 Allowed Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 120.364 -1.46 . . . . 1.44 113.174 -178.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.546 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.5 Cg_exo -57.42 -40.29 82.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 122.468 1.917 . . . . 0.31 112.663 -177.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -67.9 -46.16 72.38 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 118.204 -1.398 . . . . 0.45 108.196 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -60.18 -53.9 52.23 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.125 -0.985 . . . . 0.16 109.884 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.0 t60 -68.09 -40.17 82.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.595 -0.691 . . . . 0.35 111.391 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.463 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.51 -39.16 92.62 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.855 -1.153 . . . . 0.77 110.643 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.86 -21.91 65.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.183 -0.948 . . . . 1.07 110.368 -178.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.3 m -53.51 -34.95 59.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.854 -1.154 . . . . 0.87 108.478 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 44.8 mp0 -88.75 -14.9 36.05 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.486 -0.759 . . . . 2.16 109.123 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.13 -37.79 37.71 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.708 -1.219 . . . . 2.29 107.708 178.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -123.13 68.87 0.99 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 106.861 -1.533 . . . . 0.95 106.861 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.8 p -63.38 -8.53 9.13 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.932 -0.766 . . . . 0.89 108.932 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -90.98 8.94 32.74 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.275 -0.891 . . . . 1.13 108.62 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 42.8 t -127.29 144.97 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.685 -1.228 . . . . 1.06 107.685 178.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -99.82 123.65 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.009 -1.057 . . . . 1.04 109.473 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -104.81 125.25 50.67 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.424 -0.798 . . . . 0.13 109.7 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.466 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.7 mp -110.0 142.7 41.03 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.121 -0.987 . . . . 1.08 109.196 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -109.95 131.7 54.82 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.908 -1.516 . . . . 1.13 106.908 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.0 t -128.28 137.76 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.325 -0.859 . . . . 1.03 110.6 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 62' ' ' ALA . 58.0 t0 -100.17 119.0 37.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 1.05 108.905 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -67.96 -17.54 22.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 120.394 -1.441 . . . . 1.04 108.149 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.513 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.3 m-20 -90.01 -42.72 10.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 1.08 111.458 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -97.66 -22.15 16.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.651 -1.28 . . . . 1.07 109.276 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -115.96 38.39 3.35 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.146 -1.427 . . . . 1.03 107.146 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.614 HE21 ' H ' ' A' ' 64' ' ' ASP . 1.8 pm0 -60.34 -20.49 59.54 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.814 -0.63 . . . . 1.92 109.65 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.614 ' H ' HE21 ' A' ' 63' ' ' GLN . 1.5 p30 -63.76 -37.92 89.19 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.959 -1.088 . . . . 1.05 108.933 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.418 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 14.8 t -74.38 -43.55 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.327 -0.858 . . . . 1.1 109.532 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.26 -39.64 78.31 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.491 -0.755 . . . . 1.03 111.005 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.9 p -62.64 -35.68 80.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.915 -1.116 . . . . 0.89 109.166 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.6 -38.45 91.16 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.489 -0.757 . . . . 2.06 109.569 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.72 -0.19 56.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.282 -0.886 . . . . 1.05 111.285 -178.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 54.87 50.31 15.91 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.866 -1.146 . . . . 2.02 110.42 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.9 t -65.66 132.24 31.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 120.941 -1.1 . . . . 1.05 109.114 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -103.83 -11.94 17.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.601 -0.687 . . . . 2.16 110.693 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.463 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.9 155.27 16.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.81 -1.181 . . . . 1.04 110.348 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -126.74 155.92 74.41 Favored Pre-proline 0 N--CA 1.498 1.959 0 N-CA-C 107.6 -1.259 . . . . 1.04 107.6 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -75.99 143.91 78.14 Favored 'Cis proline' 0 N--CA 1.487 1.098 0 C-N-CA 123.681 -1.383 . . . . 0.19 112.541 -1.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.463 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.82 133.79 48.13 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.517 -0.92 . . . . 1.04 108.517 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.552 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -113.33 131.47 55.95 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.538 -0.912 . . . . 0.23 108.538 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -122.54 141.62 51.48 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.273 -0.892 . . . . 0.43 108.684 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -107.8 132.64 53.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.697 -0.627 . . . . 0.17 110.582 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -125.28 147.39 49.13 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.368 0.604 . . . . 0.17 109.499 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -148.36 124.33 10.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.305 -0.872 . . . . 2.18 109.025 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.541 ' NZ ' ' OD1' ' A' ' 20' ' ' ASP . 50.8 mttm 59.63 29.08 18.63 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.715 -1.217 . . . . 1.8 107.715 -178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.24 20.58 77.1 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.593 -1.403 . . . . 0.23 109.593 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.404 ' NE2' ' HA ' ' A' ' 84' ' ' GLN . 3.6 mm100 -124.21 137.02 54.57 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.483 -1.01 . . . . 2.75 110.965 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.64 125.42 29.34 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.1 -1.0 . . . . 2.3 108.851 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 m -124.62 13.89 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.724 -0.61 . . . . 1.06 110.703 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.45 157.55 18.63 Favored Glycine 0 N--CA 1.499 2.88 0 C-N-CA 118.969 -1.586 . . . . 0.22 111.066 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.482 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.92 148.44 7.33 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.553 -0.906 . . . . 1.93 108.553 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.482 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 3.5 p90 -168.23 157.59 9.43 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.241 -0.912 . . . . 0.16 109.749 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -126.52 159.88 32.16 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.529 -0.732 . . . . 0.9 110.041 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.95 143.7 6.62 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.805 -1.318 . . . . 0.12 109.805 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.91 64.76 3.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.19 -1.182 . . . . 1.04 109.81 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.42 94.25 4.48 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.015 -1.106 . . . . 1.36 108.015 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -31.44 71.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.04 -1.037 . . . . 1.6 111.129 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -65.3 -29.77 70.56 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.905 -1.122 . . . . 1.61 109.351 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -60.42 -34.31 73.78 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.916 -0.772 . . . . 2.02 108.916 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.67 -38.81 82.5 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.051 0.929 . . . . 1.05 108.74 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.2 -43.72 98.2 Favored 'General case' 0 C--N 1.292 -1.918 0 C-N-CA 119.785 -0.766 . . . . 2.1 110.909 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.78 -44.0 74.56 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 1.06 111.861 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.4 m -64.79 -40.06 94.62 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.741 -1.224 . . . . 1.04 109.64 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.6 mt -60.79 -49.58 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.339 -0.986 . . . . 1.04 108.339 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -60.35 -35.18 75.08 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.99 0.9 . . . . 1.09 108.581 178.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.81 -39.58 87.75 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.864 -0.523 . . . . 2.21 109.6 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.5 mt -99.63 -2.86 34.47 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.197 -0.94 . . . . 1.05 111.631 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.496 1.842 0 O-C-N 120.545 -1.347 . . . . 1.08 109.515 -179.098 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 108.815 -0.809 . . . . 1.89 108.815 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 28.5 mm -131.5 140.0 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 O-C-N 121.864 -0.522 . . . . 1.03 109.732 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.0 m -96.4 128.44 43.33 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.156 -1.424 . . . . 0.19 107.156 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 55.2 m -77.61 141.6 39.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.723 -1.235 . . . . 0.93 110.751 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.412 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.7 m95 -76.94 -11.83 59.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.439 -0.788 . . . . 0.21 108.912 178.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 m120 . . . . . 0 C--N 1.304 -1.398 0 N-CA-C 108.586 -0.894 . . . . 0.49 108.586 179.514 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.0 tptt . . . . . 0 N--CA 1.499 1.983 0 N-CA-C 108.874 -0.787 . . . . 2.18 108.874 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -97.86 121.88 40.31 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.235 -1.024 . . . . 0.4 108.235 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.0 mm -99.99 112.89 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 1.04 108.743 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.04 -0.03 47.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 2.25 109.903 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -153.53 156.39 37.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.707 -1.246 . . . . 0.91 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -65.06 -33.0 74.99 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.318 -0.993 . . . . 2.18 108.318 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 90.0 m -56.14 -48.05 76.99 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.871 -0.788 . . . . 1.03 108.871 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.67 -29.69 66.08 Favored 'General case' 0 C--N 1.295 -1.763 0 O-C-N 121.545 -0.722 . . . . 1.02 109.089 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.66 -44.09 93.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.188 -0.945 . . . . 0.15 109.164 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -65.92 -43.93 86.65 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.834 -0.802 . . . . 2.07 108.834 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -63.59 -36.31 83.38 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.465 0.65 . . . . 1.77 110.068 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.97 -43.84 78.08 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.349 -0.845 . . . . 1.04 109.439 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.88 -40.14 91.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.441 -0.787 . . . . 1.07 109.321 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -69.48 -32.61 71.61 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.426 -0.796 . . . . 1.07 110.448 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.68 83.04 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 1.07 109.355 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.82 -36.11 80.18 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.511 -0.743 . . . . 1.03 109.625 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.48 -123.27 16.29 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.976 -1.249 . . . . 0.24 109.976 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -91.15 3.75 53.98 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.195 -1.18 . . . . 1.07 110.224 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -77.14 149.18 35.65 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.994 -1.066 . . . . 2.03 109.768 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.43 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.3 153.72 21.88 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.834 -1.173 . . . . 1.23 107.834 -179.798 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.43 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 57.3 t -143.97 120.73 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 N-CA-C 107.995 -1.113 . . . . 1.03 107.995 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -108.03 140.08 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.456 -0.942 . . . . 1.03 108.456 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -123.25 119.9 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.327 -0.858 . . . . 1.01 109.462 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.568 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 25.6 t70 -97.37 108.96 21.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.496 -0.753 . . . . 1.05 110.8 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.98 103.03 15.73 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.268 -1.753 . . . . 0.73 106.268 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.4 m -130.07 150.05 51.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.016 -0.735 . . . . 0.84 109.016 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.61 120.97 29.46 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.455 -1.313 . . . . 1.04 107.455 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -65.73 -32.21 73.63 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 118.541 -1.264 . . . . 1.08 108.039 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.409 ' CD1' ' OD1' ' A' ' 60' ' ' ASP . 53.3 p-90 -70.73 -23.77 62.51 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.32 -0.863 . . . . 0.29 111.063 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -84.43 115.13 22.38 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.827 -1.171 . . . . 0.26 108.751 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.454 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.72 -50.75 64.3 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 120.819 -0.705 . . . . 0.28 111.787 -178.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.2 Cg_exo -51.97 -36.18 63.55 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 CA-C-N 118.826 1.313 . . . . 0.5 112.866 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.5 -47.83 21.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.128 -0.982 . . . . 1.04 109.623 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.28 -35.68 76.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 2.12 109.097 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.54 ' O ' ' SD ' ' A' ' 37' ' ' MET . 11.6 tmm? -59.64 -29.36 67.98 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.516 -0.74 . . . . 2.66 110.06 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 71.0 mt -82.71 -1.32 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.539 -0.726 . . . . 1.22 110.822 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.538 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.96 -30.12 6.43 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 120.535 -1.353 . . . . 1.44 113.976 -178.832 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.38 -40.6 66.08 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 CA-C-N 121.618 1.614 . . . . 0.31 113.266 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -68.8 -49.66 56.73 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 118.365 -1.334 . . . . 0.45 109.303 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.33 -51.08 71.06 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 121.761 0.791 . . . . 0.16 109.34 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.7 t60 -66.73 -40.96 88.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.621 -0.674 . . . . 0.35 110.724 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 72.3 m -63.39 -39.02 93.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.903 -1.123 . . . . 0.77 110.498 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.34 -23.08 66.57 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 1.07 111.366 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.4 m -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.788 -1.195 . . . . 0.87 108.364 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -88.94 -15.56 33.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.273 -0.892 . . . . 2.16 109.355 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -79.26 -33.81 43.17 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.151 -1.425 . . . . 2.29 107.151 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -122.16 64.43 0.93 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 106.776 -1.564 . . . . 0.95 106.776 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.5 p -61.86 -9.29 6.4 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.74 -0.837 . . . . 0.89 108.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -91.1 8.63 34.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.506 -0.746 . . . . 1.13 109.207 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.0 t -128.24 152.72 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 N-CA-C 108.225 -1.028 . . . . 1.06 108.225 178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -102.73 122.12 54.69 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.148 -0.97 . . . . 1.04 110.132 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -105.49 130.05 53.65 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.238 -0.914 . . . . 0.13 109.868 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.44 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 4.4 mp -114.29 143.14 45.36 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.307 -0.871 . . . . 1.08 109.495 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -113.66 131.08 56.28 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 106.954 -1.499 . . . . 1.13 106.954 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.4 t -128.43 136.46 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 O-C-N 121.215 -0.928 . . . . 1.03 111.344 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -99.49 120.01 38.94 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.932 -0.766 . . . . 1.05 108.932 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.7 m -68.25 -16.7 21.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 O-C-N 120.523 -1.361 . . . . 1.04 108.471 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.6 m-20 -94.47 -40.76 9.72 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.426 -0.796 . . . . 1.08 111.448 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -96.84 -16.79 20.59 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.796 -1.19 . . . . 1.07 108.62 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.61 40.67 3.67 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.489 -1.3 . . . . 1.03 107.489 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.09 -20.31 57.51 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.879 -0.513 . . . . 1.92 110.206 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.7 p30 -65.56 -38.65 90.17 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.683 -1.26 . . . . 1.05 109.176 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.492 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 20.1 t -72.76 -42.57 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.199 -0.938 . . . . 1.1 109.459 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.71 -41.95 71.25 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.484 -0.76 . . . . 1.03 110.999 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.7 p -60.14 -36.08 76.72 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.869 -1.144 . . . . 0.89 108.533 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -64.41 -39.28 93.54 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.475 -0.766 . . . . 2.06 109.492 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.56 0.45 54.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.25 -0.906 . . . . 1.05 111.019 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 54.14 50.07 17.33 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.917 -1.115 . . . . 2.02 110.059 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -65.58 131.69 31.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.787 -1.196 . . . . 1.05 109.043 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -103.71 -14.36 16.13 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.717 -0.614 . . . . 2.16 109.937 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.461 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.6 152.33 15.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.938 -1.101 . . . . 1.04 110.769 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.4 p -127.49 154.4 77.44 Favored Pre-proline 0 N--CA 1.503 2.176 0 N-CA-C 107.736 -1.209 . . . . 1.04 107.736 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -76.22 141.19 69.57 Favored 'Cis proline' 0 N--CA 1.495 1.59 0 C-N-CA 124.147 -1.189 . . . . 0.19 112.991 -1.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.2 m -126.72 139.2 53.32 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.498 -0.927 . . . . 1.04 108.498 177.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.568 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.8 m-85 -112.61 131.8 55.45 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.349 -0.982 . . . . 0.23 108.349 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.98 139.9 53.59 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.432 -0.951 . . . . 0.43 108.432 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -107.68 129.6 55.0 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.542 0.687 . . . . 0.17 110.034 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -122.58 143.27 49.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.753 -0.832 . . . . 0.17 108.753 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -146.28 130.61 17.61 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.426 -1.694 . . . . 2.18 106.426 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.2 mttt 58.17 27.75 15.52 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 108.449 -0.945 . . . . 1.8 108.449 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.3 17.26 80.1 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.893 -1.283 . . . . 0.23 109.893 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.3 mm100 -123.33 138.48 54.6 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.449 -1.03 . . . . 2.75 111.107 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -79.58 124.44 28.53 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.352 -0.842 . . . . 2.3 109.347 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.2 m -121.53 6.81 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.529 -0.732 . . . . 1.06 110.648 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.34 155.56 15.31 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 118.666 -1.731 . . . . 0.22 111.321 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -164.25 149.89 10.61 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.812 -0.816 . . . . 1.93 109.546 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.407 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 17.8 p90 -163.01 161.81 25.65 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.92 -1.112 . . . . 0.16 109.151 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -127.0 162.38 26.14 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.485 0.66 . . . . 0.9 110.276 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.27 141.66 6.78 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.465 -1.454 . . . . 0.12 109.465 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.01 64.88 1.97 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.34 -1.094 . . . . 1.04 109.795 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.47 95.9 5.17 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.558 -0.904 . . . . 1.36 108.558 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -34.1 73.15 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.248 -0.908 . . . . 1.6 111.212 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.24 -30.1 70.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.806 -1.184 . . . . 1.61 108.783 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -61.98 -34.43 76.14 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.746 -0.596 . . . . 2.02 109.404 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.8 mt -59.87 -39.93 86.93 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.13 0.967 . . . . 1.05 108.888 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -61.65 -43.64 98.48 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.581 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.29 -44.09 76.25 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.282 -0.886 . . . . 1.06 111.629 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.4 -40.02 92.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.733 -1.229 . . . . 1.04 109.659 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.6 mt -60.94 -49.48 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.206 -1.035 . . . . 1.04 108.206 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -60.12 -34.78 73.98 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.48 -0.933 . . . . 1.09 108.48 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -67.91 -40.05 83.48 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.688 -0.632 . . . . 2.21 110.325 -178.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.9 mt -98.77 -3.68 35.09 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.148 -0.97 . . . . 1.05 111.117 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.492 1.631 0 O-C-N 120.548 -1.345 . . . . 1.08 109.076 -179.036 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 109.416 -0.587 . . . . 1.89 109.416 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 31.7 mm -129.17 140.07 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.622 -0.674 . . . . 1.03 109.967 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 63.3 m -96.75 124.35 40.71 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.163 -1.421 . . . . 0.19 107.163 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -77.61 141.57 39.41 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.845 -1.159 . . . . 0.93 110.908 -178.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 20.2 m95 -76.56 -10.01 59.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.005 -1.059 . . . . 0.21 108.508 178.565 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--N 1.304 -1.383 0 N-CA-C 108.577 -0.897 . . . . 0.49 108.577 179.847 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.8 tptt . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 108.269 -1.011 . . . . 2.18 108.269 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -98.01 123.7 42.14 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.331 -0.989 . . . . 0.4 108.331 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.0 mm -101.56 112.79 35.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.186 -0.946 . . . . 1.04 108.508 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.444 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 50.4 mp0 -95.87 -1.26 49.78 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.313 -0.867 . . . . 2.25 109.392 -179.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -153.98 154.8 34.41 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.947 -1.096 . . . . 0.91 111.439 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.9 ttpp -63.38 -31.16 72.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.98 -1.119 . . . . 2.18 107.98 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.8 m -59.05 -46.65 87.7 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.934 -0.765 . . . . 1.03 108.934 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 -30.02 66.4 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.288 -0.883 . . . . 1.02 108.692 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -59.45 -43.83 93.08 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.119 -0.988 . . . . 0.15 109.321 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -63.68 -41.98 98.09 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 119.634 -0.827 . . . . 2.07 108.796 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -64.94 -39.87 94.17 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.666 -0.646 . . . . 1.77 110.483 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -41.24 94.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.308 -0.87 . . . . 1.04 108.966 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.6 mt -61.23 -40.17 93.01 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.112 -0.993 . . . . 1.07 108.734 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.28 -34.55 72.91 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.965 -0.694 . . . . 1.07 109.698 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.03 80.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.362 -0.836 . . . . 1.07 110.298 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.23 70.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.069 -1.02 . . . . 1.03 109.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.81 -124.57 21.07 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.144 -1.582 . . . . 0.24 109.144 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -91.97 0.46 57.47 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -1.085 . . . . 1.07 110.336 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -75.72 149.89 37.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.996 -1.065 . . . . 2.03 109.345 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.1 mt -55.81 160.58 2.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.019 -1.051 . . . . 1.23 110.213 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.1 t -148.62 108.35 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 107.995 -1.113 . . . . 1.03 107.995 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.3 t -100.95 140.8 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 107.606 -1.257 . . . . 1.03 107.606 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -124.63 124.5 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.186 -0.946 . . . . 1.01 109.748 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -101.09 116.96 34.05 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.431 -0.793 . . . . 1.05 110.022 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -91.95 22.53 4.22 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.73 110.265 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -54.52 144.42 21.38 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.666 -1.271 . . . . 0.84 110.667 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.99 127.97 33.17 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.084 -1.45 . . . . 1.04 107.084 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -67.94 -31.32 70.99 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.832 -1.147 . . . . 1.08 108.527 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.503 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 69.7 p-90 -76.53 -13.53 60.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.342 -0.849 . . . . 0.29 111.467 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.3 t -87.98 114.27 24.44 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.679 -1.263 . . . . 0.26 108.592 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.463 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.25 -51.94 54.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.647 -0.981 . . . . 0.28 110.647 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 32.9 Cg_exo -50.44 -38.04 52.65 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 CA-C-N 118.463 1.132 . . . . 0.5 112.183 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.99 -43.74 23.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 1.04 109.66 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -59.96 -32.13 70.53 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.986 -1.071 . . . . 2.12 108.819 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 54.5 ttm -60.41 -29.28 68.87 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 2.66 109.828 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 17.1 mt -80.29 -4.21 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.934 -0.479 . . . . 1.22 110.997 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.69 -30.93 7.11 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 119.823 -1.798 . . . . 1.44 113.724 -177.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.3 Cg_exo -59.5 -36.42 93.33 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 CA-C-N 121.586 1.602 . . . . 0.31 112.0 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -72.41 -51.63 19.52 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 118.686 -1.206 . . . . 0.45 108.874 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -59.61 -48.28 82.27 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.892 -0.781 . . . . 0.16 108.892 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -68.18 -42.46 79.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.298 -0.876 . . . . 0.35 110.812 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.3 m -64.52 -37.09 86.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.927 -1.108 . . . . 0.77 110.771 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.8 -22.78 66.87 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.125 -0.984 . . . . 1.07 110.525 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -53.57 -37.14 62.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.766 -1.209 . . . . 0.87 107.903 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -87.85 -15.34 37.05 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.556 -0.715 . . . . 2.16 109.501 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -76.69 -38.26 54.73 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.254 -1.387 . . . . 2.29 107.254 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -123.66 69.37 1.04 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.183 -1.414 . . . . 0.95 107.183 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.3 p -64.18 -8.98 14.17 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.012 -0.736 . . . . 0.89 109.012 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -89.07 8.54 29.3 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.621 -0.881 . . . . 1.13 108.621 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.36 146.46 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.059 -1.089 . . . . 1.06 108.059 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.1 mm -99.79 119.75 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 120.997 -1.064 . . . . 1.04 109.828 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -101.15 127.85 47.52 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.273 -0.892 . . . . 0.13 109.98 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.456 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.7 mp -110.75 143.0 41.95 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.229 -0.919 . . . . 1.08 110.13 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -113.53 129.66 56.51 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 106.973 -1.492 . . . . 1.13 106.973 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.5 t -127.97 132.0 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.152 -0.968 . . . . 1.03 110.914 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -93.74 119.88 33.29 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.815 -0.809 . . . . 1.05 108.815 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.19 -17.33 22.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 120.672 -1.267 . . . . 1.04 107.797 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.503 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.18 -43.97 9.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 1.08 111.527 -178.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -94.41 -14.99 24.7 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.649 -1.282 . . . . 1.07 108.573 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.02 37.62 4.37 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.966 -1.124 . . . . 1.03 107.966 179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.57 -18.14 38.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.8 -0.563 . . . . 1.92 110.668 -178.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 1.3 p30 -66.36 -43.08 87.02 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.838 -1.164 . . . . 1.05 108.719 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.2 t -68.72 -44.62 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.469 -0.769 . . . . 1.1 110.056 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.25 -39.08 75.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.426 -0.796 . . . . 1.03 110.663 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -62.62 -32.79 73.87 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.942 -1.099 . . . . 0.89 109.154 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.05 -39.86 95.02 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.494 -0.754 . . . . 2.06 109.617 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.33 2.03 51.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -0.932 . . . . 1.05 110.476 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 53.14 51.55 15.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.322 -0.861 . . . . 2.02 108.788 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.5 t -63.97 131.14 29.55 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 C-N-CA 118.517 -1.273 . . . . 1.05 108.391 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -103.77 -11.38 17.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.679 -0.638 . . . . 2.16 110.707 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.7 154.87 18.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.709 -1.245 . . . . 1.04 111.167 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -126.34 154.53 74.77 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.359 -0.978 . . . . 1.04 108.359 178.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.35 143.69 75.54 Favored 'Cis proline' 0 N--CA 1.494 1.518 0 C-N-CA 123.829 -1.321 . . . . 0.19 112.615 -2.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 86.0 m -129.66 131.19 46.32 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.556 0.693 . . . . 1.04 109.305 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -108.59 132.76 53.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.6 -0.687 . . . . 0.23 109.221 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -122.72 141.07 52.18 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.506 -0.924 . . . . 0.43 108.506 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -108.51 133.9 52.03 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.741 -0.599 . . . . 0.17 110.167 -179.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -124.56 147.26 48.54 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.502 0.668 . . . . 0.17 109.837 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -144.99 128.58 17.1 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.87 -1.159 . . . . 2.18 107.87 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 49.69 38.78 16.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.116 -0.99 . . . . 1.8 108.335 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.73 24.29 76.38 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.796 -1.192 . . . . 0.23 110.169 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -128.37 135.12 49.11 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.333 -1.098 . . . . 2.75 110.339 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -79.46 127.38 32.05 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.035 -1.04 . . . . 2.3 109.312 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.9 m -124.19 5.59 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.71 -0.619 . . . . 1.06 110.692 -179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.82 154.22 13.89 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 118.465 -1.826 . . . . 0.22 111.476 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.7 tm-20 -164.88 149.71 9.39 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.788 -0.83 . . . . 1.93 109.305 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 15.1 p90 -163.18 160.97 24.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.192 -1.003 . . . . 0.16 109.524 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.73 159.99 30.9 Favored 'General case' 0 N--CA 1.5 2.053 0 CA-C-O 121.388 0.614 . . . . 0.9 109.71 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.88 142.14 6.09 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 108.933 -1.667 . . . . 0.12 108.933 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.09 66.01 4.42 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.217 -1.167 . . . . 1.04 109.94 -179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.6 t-20 -119.64 99.89 6.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.351 -0.843 . . . . 1.36 109.306 178.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.47 -33.51 74.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.341 -0.849 . . . . 1.6 111.672 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.22 -27.13 67.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.438 -1.414 . . . . 1.61 109.376 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 22.5 ttmt -61.13 -37.75 83.93 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.144 -1.058 . . . . 2.02 108.144 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.5 mt -58.63 -39.6 80.99 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 122.056 0.931 . . . . 1.05 108.5 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -61.53 -43.22 99.25 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.21 -0.596 . . . . 2.1 111.005 -178.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.53 -43.99 71.9 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.094 -1.004 . . . . 1.06 112.08 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.99 -39.23 93.16 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.798 -1.189 . . . . 1.04 110.172 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.98 -49.57 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.097 -1.002 . . . . 1.04 108.377 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -60.91 -35.76 77.52 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.589 -0.893 . . . . 1.09 108.589 179.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . 0.423 ' O ' ' OE2' ' A' ' 103' ' ' GLU . 2.5 tm-20 -68.25 -39.1 82.35 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.695 -0.628 . . . . 2.21 110.166 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.91 -6.5 28.77 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.002 -1.061 . . . . 1.05 111.534 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.408 ' O ' ' CG1' ' A' ' 105' ' ' VAL . 7.9 p . . . . . 0 N--CA 1.501 2.101 0 O-C-N 120.441 -1.412 . . . . 1.08 109.657 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 108.765 -0.828 . . . . 1.89 108.765 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 29.4 mm -130.07 140.32 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.794 -0.566 . . . . 1.03 109.571 -179.875 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -99.83 129.83 45.97 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 106.759 -1.571 . . . . 0.19 106.759 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.1 m -81.46 138.4 35.52 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.535 -1.353 . . . . 0.93 111.321 -178.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 19.2 m95 -72.11 -9.79 58.9 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.064 -1.022 . . . . 0.21 109.572 178.845 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 m120 . . . . . 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.49 109.272 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 80.2 tttt . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 108.885 -0.783 . . . . 2.18 108.885 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -94.3 124.12 38.12 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.359 -0.978 . . . . 0.4 108.359 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -100.16 112.85 33.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 108.478 -0.934 . . . . 1.04 108.478 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.454 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -97.39 -0.26 46.61 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.063 -1.023 . . . . 2.25 109.652 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -155.16 159.15 39.94 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.993 -1.067 . . . . 0.91 111.216 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -63.5 -32.34 73.76 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.073 -1.084 . . . . 2.18 108.073 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.432 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 88.1 m -57.76 -48.35 79.9 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.665 -0.814 . . . . 1.03 108.813 -179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -30.86 69.45 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.259 -0.901 . . . . 1.02 108.715 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -59.33 -43.87 92.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.149 -0.969 . . . . 0.15 109.06 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -66.35 -42.99 87.27 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 120.046 -0.662 . . . . 2.07 109.449 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -65.12 -39.94 93.79 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.69 -0.631 . . . . 1.77 110.328 179.629 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.73 88.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.081 -1.012 . . . . 1.04 109.446 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.8 mt -60.71 -39.94 90.42 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.162 -1.051 . . . . 1.07 108.162 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -69.84 -36.96 75.99 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.674 -0.641 . . . . 1.07 110.205 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.76 -37.48 82.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.51 -0.744 . . . . 1.07 109.926 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.07 72.93 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.871 . . . . 1.03 109.649 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -125.87 24.67 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 110.015 -1.234 . . . . 0.24 110.015 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -92.02 5.9 48.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.107 -1.231 . . . . 1.07 110.203 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -76.39 149.36 36.93 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.838 -1.164 . . . . 2.03 109.472 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.46 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.05 155.53 16.78 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.523 -1.288 . . . . 1.23 107.523 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.46 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 64.7 t -143.22 111.54 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 O-C-N 120.919 -1.113 . . . . 1.03 109.059 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.0 t -100.65 141.88 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 107.91 -1.145 . . . . 1.03 107.91 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.06 124.31 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.341 -0.85 . . . . 1.01 109.443 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.5 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.637 -0.664 . . . . 1.05 110.144 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -95.91 23.17 6.58 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.348 -0.845 . . . . 0.73 109.95 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.5 m -59.02 145.25 42.58 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.844 -1.16 . . . . 0.84 110.385 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.05 126.81 33.42 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.547 -1.279 . . . . 1.04 107.547 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -68.27 -28.31 67.09 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 118.848 -1.141 . . . . 1.08 108.781 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.541 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 60.8 p-90 -77.42 -19.22 56.4 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.079 -1.013 . . . . 0.29 110.072 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.2 t -83.84 122.45 28.71 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.167 -1.049 . . . . 0.26 108.167 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.461 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.6 -54.08 34.11 Favored Glycine 0 N--CA 1.488 2.113 0 C-N-CA 120.728 -0.749 . . . . 0.28 111.977 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.3 Cg_endo -59.53 -31.04 93.93 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 CA-C-N 119.588 1.694 . . . . 0.5 112.404 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.69 -55.48 5.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.036 -1.04 . . . . 1.04 109.805 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -60.16 -38.43 83.15 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.942 -1.099 . . . . 2.12 110.25 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.33 -28.79 67.14 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.088 -1.008 . . . . 2.66 109.677 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.437 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 65.8 mt -83.36 -3.86 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.751 -0.593 . . . . 1.22 111.312 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.4 ptmt -66.67 -29.83 3.0 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 120.262 -1.524 . . . . 1.44 113.468 -177.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -54.74 -39.83 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.759 1.664 . . . . 0.31 112.409 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -68.74 -44.05 74.61 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 118.187 -1.405 . . . . 0.45 108.134 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -60.34 -54.18 48.77 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.33 -0.856 . . . . 0.16 109.533 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.3 t60 -66.98 -39.92 87.29 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.82 -0.55 . . . . 0.35 110.554 -179.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.7 m -61.47 -37.79 84.91 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.87 -1.144 . . . . 0.77 110.286 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.3 mt -60.99 -23.6 65.49 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.334 -0.854 . . . . 1.07 110.298 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -54.79 -38.94 67.91 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.069 -1.02 . . . . 0.87 108.915 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.8 mp0 -87.87 -13.51 41.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 2.16 109.733 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -80.34 -37.49 32.42 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 105.76 -1.941 . . . . 2.29 105.76 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -123.1 66.75 0.98 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.199 -1.408 . . . . 0.95 107.199 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.3 p -62.33 -8.32 5.73 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.952 -0.759 . . . . 0.89 108.952 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -91.03 9.72 29.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.737 -0.838 . . . . 1.13 108.737 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.5 t -129.3 147.01 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 N-CA-C 108.169 -1.048 . . . . 1.06 108.169 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.8 120.1 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 120.961 -1.087 . . . . 1.04 110.165 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -102.28 127.84 49.08 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.985 -1.072 . . . . 0.13 109.348 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 1.9 mp -110.02 140.3 44.19 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.245 -0.909 . . . . 1.08 109.389 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -110.4 129.52 55.74 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.69 -1.596 . . . . 1.13 106.69 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.67 129.87 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 121.555 0.693 . . . . 1.03 110.252 -178.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.418 ' O ' ' N ' ' A' ' 62' ' ' ALA . 55.7 t0 -93.24 119.58 32.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.333 -0.988 . . . . 1.05 108.333 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -67.29 -20.46 26.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 C-N-CA 118.301 -1.36 . . . . 1.04 108.186 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.541 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.39 -42.12 10.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.433 -0.792 . . . . 1.08 111.696 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -96.18 -13.86 23.2 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.688 -1.257 . . . . 1.07 108.412 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -126.06 40.05 3.81 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.703 -1.221 . . . . 1.03 107.703 179.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -59.86 -24.81 64.53 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.841 -0.537 . . . . 1.92 109.969 -178.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.52 -39.36 91.71 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.79 -1.194 . . . . 1.05 109.497 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.517 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 15.2 t -69.92 -44.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.133 -0.979 . . . . 1.1 109.669 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -36.52 66.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.681 -0.637 . . . . 1.03 110.847 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.8 p -60.55 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.89 109.573 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.3 -37.08 85.85 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.292 -0.88 . . . . 2.06 109.537 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.13 -0.15 53.59 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 1.05 111.04 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.2 mp0 54.38 49.41 18.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.984 -1.073 . . . . 2.02 109.845 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.85 134.35 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 120.833 -1.167 . . . . 1.05 108.763 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -106.43 -12.48 15.63 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.527 -0.733 . . . . 2.16 110.474 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.26 153.37 19.86 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.836 -1.165 . . . . 1.04 110.562 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -125.2 155.65 70.88 Favored Pre-proline 0 N--CA 1.499 2.016 0 N-CA-C 107.861 -1.163 . . . . 1.04 107.861 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -76.35 145.09 81.22 Favored 'Cis proline' 0 N--CA 1.491 1.341 0 C-N-CA 123.724 -1.365 . . . . 0.19 112.514 -2.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.7 m -129.45 132.2 46.91 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 108.735 -0.839 . . . . 1.04 108.735 178.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.5 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.0 m-85 -110.16 130.76 55.49 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 109.109 -0.7 . . . . 0.23 109.109 -179.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -122.82 139.34 54.12 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.739 -0.838 . . . . 0.43 108.739 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -106.83 132.06 53.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.356 0.598 . . . . 0.17 110.197 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -125.94 147.75 49.42 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.181 -0.674 . . . . 0.17 109.181 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -147.18 125.54 12.32 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.483 -1.303 . . . . 2.18 107.483 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.1 mttt 59.58 28.22 17.58 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.195 -1.409 . . . . 1.8 107.195 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.415 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 76.34 16.24 80.86 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.996 -1.242 . . . . 0.23 109.996 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.415 HE21 ' C ' ' A' ' 83' ' ' GLY . 7.0 mm-40 -115.57 132.94 56.47 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.472 -1.016 . . . . 2.75 110.467 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -77.14 124.22 27.5 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 107.896 -1.15 . . . . 2.3 107.896 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.8 m -123.52 11.88 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.696 -0.627 . . . . 1.06 110.06 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.23 156.03 15.08 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 118.909 -1.615 . . . . 0.22 111.251 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -166.4 148.0 6.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.886 -0.773 . . . . 1.93 109.223 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.596 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 7.1 p90 -164.47 159.04 18.99 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 119.828 -0.749 . . . . 0.16 109.523 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.67 161.39 28.19 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.558 0.694 . . . . 0.9 110.022 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.98 142.1 5.93 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.519 -1.433 . . . . 0.12 109.519 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.26 65.06 2.78 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -1.094 . . . . 1.04 109.721 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -120.04 90.82 3.4 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.398 -0.964 . . . . 1.36 108.398 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.409 ' CD ' ' H ' ' A' ' 94' ' ' LYS . 0.2 OUTLIER -64.47 -35.13 79.95 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.068 -1.02 . . . . 1.6 111.546 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -62.04 -30.06 70.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.798 -1.189 . . . . 1.61 109.969 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.596 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 58.3 tttm -61.46 -32.91 72.91 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.669 0.747 . . . . 2.02 109.314 -179.183 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.0 mt -59.62 -39.68 85.04 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.215 -1.031 . . . . 1.05 108.215 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.47 -41.36 97.12 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 120.073 -0.651 . . . . 2.1 110.547 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.82 -43.45 75.54 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.087 -1.008 . . . . 1.06 111.698 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.8 m -67.3 -36.09 80.81 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.757 -1.214 . . . . 1.04 109.949 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.7 -50.11 79.34 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.061 -1.024 . . . . 1.04 108.35 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -60.03 -34.47 73.42 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.256 -1.016 . . . . 1.09 108.256 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.07 -39.97 82.82 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.752 -0.592 . . . . 2.21 110.406 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.8 mt -98.95 -2.99 36.07 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.218 -0.926 . . . . 1.05 111.293 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.2 p . . . . . 0 N--CA 1.496 1.87 0 O-C-N 120.413 -1.43 . . . . 1.08 109.11 -179.535 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 109.674 -0.491 . . . . 1.89 109.674 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.7 mm -129.02 140.11 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 N-CA-C 109.259 -0.645 . . . . 1.03 109.259 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.0 m -98.29 131.55 44.52 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 107.272 -1.381 . . . . 0.19 107.272 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -81.46 140.12 34.8 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.614 -1.304 . . . . 0.93 111.29 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 25.1 m95 -74.22 -10.1 59.27 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.203 -0.936 . . . . 0.21 109.697 179.021 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . 0.416 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.9 m120 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.008 -1.057 . . . . 0.49 108.76 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.9 tptt . . . . . 0 N--CA 1.499 2.013 0 N-CA-C 108.122 -1.066 . . . . 2.18 108.122 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -97.13 123.24 40.84 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.339 -0.986 . . . . 0.4 108.339 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.0 mm -100.3 112.8 34.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.774 -0.824 . . . . 1.04 108.774 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.4 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -94.63 -2.01 52.15 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 120.916 -1.115 . . . . 2.25 110.203 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -152.21 154.08 35.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.659 -1.275 . . . . 0.91 110.801 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -63.45 -32.42 73.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.258 -1.016 . . . . 2.18 108.258 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.6 m -57.89 -46.73 84.48 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.285 -0.966 . . . . 1.03 108.651 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.12 -29.53 67.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.412 -0.805 . . . . 1.02 108.992 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -59.85 -44.09 94.31 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.479 -0.934 . . . . 0.15 108.479 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.32 -43.64 94.03 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.016 -0.735 . . . . 2.07 109.016 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -64.29 -35.8 82.03 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.376 0.608 . . . . 1.77 109.819 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.04 -41.67 81.7 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.271 -0.893 . . . . 1.04 109.045 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.6 mt -61.0 -41.22 96.09 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.104 -1.038 . . . . 1.07 108.668 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -69.5 -39.28 77.68 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.399 -0.813 . . . . 1.07 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.36 80.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.257 -0.902 . . . . 1.07 110.405 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.82 -28.62 69.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.162 -0.961 . . . . 1.03 110.257 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.02 -130.7 30.33 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.045 -1.222 . . . . 0.24 110.045 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -89.97 2.47 55.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.124 -1.221 . . . . 1.07 110.698 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -76.73 150.44 36.26 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.902 -1.124 . . . . 2.03 109.474 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 12.2 mt -57.97 158.64 6.42 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.106 -0.996 . . . . 1.23 111.011 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.1 t -147.06 108.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.432 -0.951 . . . . 1.03 108.432 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.7 t -101.48 143.53 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.227 -1.397 . . . . 1.03 107.227 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -125.18 123.24 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.319 -0.863 . . . . 1.01 110.139 -178.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.522 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.16 123.57 42.28 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.006 -0.738 . . . . 1.05 109.006 179.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.72 24.34 8.46 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.997 -1.065 . . . . 0.73 109.601 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.408 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 46.8 m -58.47 147.9 30.14 Favored 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.09 -1.006 . . . . 0.84 110.498 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.44 127.29 34.34 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 107.422 -1.325 . . . . 1.04 107.422 178.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.2 t -66.93 -30.92 71.19 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.695 -1.202 . . . . 1.08 108.949 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.535 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 64.0 p-90 -76.61 -16.48 59.56 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.09 -1.006 . . . . 0.29 111.565 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -86.38 114.0 22.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.616 -1.302 . . . . 0.26 108.408 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.448 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.98 -51.37 59.3 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 120.317 -0.944 . . . . 0.28 111.232 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.448 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 32.8 Cg_exo -50.44 -37.6 51.71 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 CA-C-N 118.96 1.38 . . . . 0.5 112.396 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.85 -44.17 28.08 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.272 -0.893 . . . . 1.04 109.331 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -59.85 -32.02 70.29 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.534 -0.913 . . . . 2.12 108.534 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.8 ttt -60.14 -29.3 68.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.582 -0.699 . . . . 2.66 109.797 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.6 mt -83.01 -4.65 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.512 -0.743 . . . . 1.22 110.833 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.535 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.18 -32.45 10.83 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 119.701 -1.874 . . . . 1.44 113.131 -176.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.7 Cg_exo -58.82 -36.53 96.86 Favored 'Trans proline' 0 N--CA 1.493 1.446 0 CA-C-N 121.675 1.634 . . . . 0.31 112.046 -178.226 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.41 -51.88 18.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.822 -1.174 . . . . 0.45 109.007 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.37 -46.85 87.5 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.155 0.979 . . . . 0.16 108.744 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -68.07 -46.88 69.82 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 115.918 -0.583 . . . . 0.35 110.866 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.464 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 72.8 m -60.88 -38.87 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.091 -1.005 . . . . 0.77 110.343 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.32 -24.52 66.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.263 -0.898 . . . . 1.07 111.07 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.4 m -54.1 -37.75 64.62 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.659 -1.275 . . . . 0.87 108.109 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -85.44 -18.22 34.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.917 -1.114 . . . . 2.16 109.789 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -74.84 -37.03 62.35 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.052 -1.462 . . . . 2.29 107.052 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -122.99 68.07 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 107.243 -1.391 . . . . 0.95 107.243 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.6 p -64.7 -8.71 15.7 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.97 -0.752 . . . . 0.89 108.97 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -91.66 6.72 44.72 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 1.13 108.385 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.4 t -126.02 146.02 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 107.73 -1.211 . . . . 1.06 107.73 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.2 mm -99.1 124.88 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.132 -0.98 . . . . 1.04 109.73 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -107.09 127.74 53.75 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.288 -0.882 . . . . 0.13 109.529 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.431 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.3 mp -110.93 140.21 45.62 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.047 -1.033 . . . . 1.08 110.056 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -109.77 129.89 55.57 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.52 -1.659 . . . . 1.13 106.52 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.6 t -125.37 135.09 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.193 -0.942 . . . . 1.03 110.109 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -98.19 117.44 32.57 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.745 -0.835 . . . . 1.05 108.745 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.5 m -65.01 -19.47 25.72 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 120.526 -1.359 . . . . 1.04 108.19 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.19 -41.19 11.13 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 1.08 111.949 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -97.49 -18.36 19.06 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.611 -1.306 . . . . 1.07 108.826 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.31 39.1 3.8 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 107.925 -1.139 . . . . 1.03 107.925 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -60.06 -19.56 53.59 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.745 -0.597 . . . . 1.92 109.702 -178.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -63.55 -35.76 81.54 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.894 -1.129 . . . . 1.05 109.066 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.485 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 13.2 t -73.4 -41.31 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.067 -1.021 . . . . 1.1 108.951 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.69 -41.91 78.52 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.64 -0.663 . . . . 1.03 110.638 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.0 p -60.01 -39.14 84.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.842 -1.161 . . . . 0.89 108.847 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -65.79 -40.06 91.59 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.352 -0.842 . . . . 2.06 109.465 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.61 -3.9 58.96 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.203 -0.935 . . . . 1.05 111.388 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 53.35 49.67 19.21 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.834 -1.166 . . . . 2.02 110.476 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.08 132.83 32.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 O-C-N 120.602 -1.311 . . . . 1.05 108.52 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -103.68 -12.16 17.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.396 -0.815 . . . . 2.16 110.67 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.468 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -158.4 155.36 28.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.709 -1.245 . . . . 1.04 110.905 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.8 154.58 81.06 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 108.007 -1.108 . . . . 1.04 108.007 179.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -77.04 141.92 70.8 Favored 'Cis proline' 0 N--CA 1.49 1.309 0 C-N-CA 123.666 -1.389 . . . . 0.19 112.462 -2.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.8 m -125.95 136.13 52.65 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.659 -0.867 . . . . 1.04 108.659 178.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.522 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.9 m-85 -111.75 132.95 54.31 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.505 -0.924 . . . . 0.23 108.505 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -123.83 143.23 50.46 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.661 -0.866 . . . . 0.43 108.661 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -108.65 129.74 55.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.468 0.651 . . . . 0.17 110.722 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -124.15 142.26 51.37 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.86 -0.793 . . . . 0.17 108.86 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -146.44 127.05 14.2 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.531 -1.285 . . . . 2.18 107.531 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.8 mttt 60.07 28.88 18.48 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.433 -0.792 . . . . 1.8 109.282 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.94 14.42 82.02 Favored Glycine 0 N--CA 1.495 2.63 0 O-C-N 120.857 -1.152 . . . . 0.23 110.664 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -124.11 144.3 49.96 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.335 -1.097 . . . . 2.75 110.877 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -81.92 126.71 32.23 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.593 -0.692 . . . . 2.3 109.16 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.67 9.58 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.617 -0.677 . . . . 1.06 110.707 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.23 162.56 28.69 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 118.239 -1.934 . . . . 0.22 111.471 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -168.42 148.05 4.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.97 -0.752 . . . . 1.93 108.97 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.485 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 4.1 p90 -167.78 156.01 9.07 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.197 -0.94 . . . . 0.16 109.664 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.9 p -126.34 160.0 31.61 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.563 -0.71 . . . . 0.9 109.997 -179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.14 141.51 5.78 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.471 -1.452 . . . . 0.12 109.471 179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.16 65.41 2.13 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.288 -1.125 . . . . 1.04 110.056 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.52 97.71 5.78 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.642 -0.873 . . . . 1.36 108.642 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -32.47 71.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.069 -1.019 . . . . 1.6 111.732 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -64.25 -30.05 71.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.082 -1.011 . . . . 1.61 109.321 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -60.42 -35.47 75.86 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.301 -0.629 . . . . 2.02 109.301 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.0 mt -59.79 -39.87 86.41 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.145 0.974 . . . . 1.05 108.797 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -63.24 -40.43 97.41 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.967 -0.693 . . . . 2.1 110.755 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -44.3 72.45 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.078 -1.013 . . . . 1.06 111.754 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.0 m -67.11 -38.55 85.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.771 -1.205 . . . . 1.04 109.819 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.7 mt -60.91 -49.93 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.187 -0.946 . . . . 1.04 108.494 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.01 -36.38 77.08 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 122.055 0.931 . . . . 1.09 109.074 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -67.2 -40.16 86.45 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.732 -0.605 . . . . 2.21 110.38 -178.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.3 mt -99.36 -4.7 31.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.12 -0.988 . . . . 1.05 111.225 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.497 1.901 0 O-C-N 120.207 -1.558 . . . . 1.08 109.366 -178.71 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.458 -0.571 . . . . 1.89 109.458 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.8 mm -128.9 141.57 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.896 -0.503 . . . . 1.03 110.169 -179.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.5 m -101.21 128.25 47.42 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.799 -1.556 . . . . 0.19 106.799 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.9 m -79.84 141.1 36.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.759 -1.213 . . . . 0.93 110.442 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.468 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.2 m95 -74.47 -12.23 60.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.217 -0.927 . . . . 0.21 109.316 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.488 1.437 0 O-C-N 121.145 -0.972 . . . . 0.49 108.919 -179.982 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.3 tptt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 108.486 -0.931 . . . . 2.18 108.486 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.41 125.1 41.84 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.227 -0.921 . . . . 0.4 108.829 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.9 mm -103.03 113.6 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 108.382 -0.97 . . . . 1.04 108.382 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -96.88 -0.64 47.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.011 -1.056 . . . . 2.25 109.843 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -154.7 156.53 36.56 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.014 -1.054 . . . . 0.91 110.802 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -63.62 -31.95 73.27 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.289 -1.004 . . . . 2.18 108.289 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.451 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 59.3 m -57.15 -48.21 79.25 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.403 -0.919 . . . . 1.03 108.826 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.36 -28.82 66.54 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.205 -0.934 . . . . 1.02 108.959 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -59.9 -43.94 94.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.323 -0.861 . . . . 0.15 109.272 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -65.59 -42.55 91.57 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.823 -0.751 . . . . 2.07 109.052 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.55 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.67 -40.05 95.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 1.77 110.394 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.24 90.86 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.137 -0.977 . . . . 1.04 109.239 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.222 -1.029 . . . . 1.07 108.222 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -70.07 -35.31 74.13 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.926 -0.71 . . . . 1.07 110.127 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.05 -36.65 77.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.095 -1.003 . . . . 1.07 110.001 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.32 -34.76 77.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.918 -1.114 . . . . 1.03 109.507 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.37 -124.52 19.2 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 110.125 -1.19 . . . . 0.24 110.125 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -91.92 5.2 50.97 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.943 -1.328 . . . . 1.07 110.307 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -77.29 149.33 35.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.004 -1.06 . . . . 2.03 109.021 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.455 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.2 156.49 18.31 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.614 -1.254 . . . . 1.23 107.614 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.455 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 84.5 t -143.78 113.04 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.807 -1.183 . . . . 1.03 109.205 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.3 t -101.22 142.39 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.392 -0.966 . . . . 1.03 108.392 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -125.42 121.96 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.218 -0.926 . . . . 1.01 109.582 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -98.82 120.9 40.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.355 -0.841 . . . . 1.05 110.346 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -95.94 24.43 5.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.73 109.49 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -59.22 145.79 41.53 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.154 -0.966 . . . . 0.84 110.545 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.21 123.3 31.33 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.406 -0.961 . . . . 1.04 108.406 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.91 -30.96 70.42 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.91 -1.144 . . . . 1.08 107.91 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.527 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 55.8 p-90 -71.38 -26.38 62.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.373 -0.829 . . . . 0.29 110.6 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.27 123.68 29.83 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.803 -1.186 . . . . 0.26 107.967 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.423 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.08 -53.07 32.06 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.506 -0.854 . . . . 0.28 111.534 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.4 Cg_exo -51.55 -31.96 41.9 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 CA-C-N 118.704 1.252 . . . . 0.5 112.095 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.38 -50.67 10.48 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.377 -0.827 . . . . 1.04 109.725 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.67 -39.27 83.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.282 -0.887 . . . . 2.12 109.468 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.3 ttm -57.6 -27.7 62.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.474 -0.766 . . . . 2.66 109.622 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.3 mt -85.29 -2.99 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 1.22 111.374 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.35 -30.13 6.22 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 120.447 -1.408 . . . . 1.44 113.454 -179.289 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 33.8 Cg_exo -59.28 -41.62 57.47 Favored 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 121.52 1.578 . . . . 0.31 113.642 -176.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.98 -45.27 74.59 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 117.589 -1.644 . . . . 0.45 107.771 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -59.69 -54.37 47.14 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.202 -0.936 . . . . 0.16 110.239 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -68.24 -40.0 82.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.546 -0.721 . . . . 0.35 110.866 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.5 m -61.18 -39.03 88.61 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.823 -1.173 . . . . 0.77 110.755 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -61.93 -22.51 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.143 -0.973 . . . . 1.07 110.901 -178.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.9 m -54.12 -35.45 62.2 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 120.82 -1.175 . . . . 0.87 108.457 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -88.26 -14.78 37.55 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.485 -0.759 . . . . 2.16 108.961 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.34 -36.21 39.8 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 106.955 -1.498 . . . . 2.29 106.955 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.413 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 78.0 m-85 -124.82 68.83 1.1 Allowed 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.29 -1.374 . . . . 0.95 107.29 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 71.7 p -65.11 -8.5 16.97 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.496 -0.752 . . . . 0.89 109.188 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -89.02 6.09 41.34 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.6 t -126.09 145.56 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 107.441 -1.318 . . . . 1.06 107.441 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.0 122.24 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.159 0 O-C-N 121.164 -0.96 . . . . 1.04 109.456 -178.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -103.12 125.17 49.71 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.317 -0.864 . . . . 0.13 109.549 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.475 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 6.0 mp -110.09 142.04 42.1 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -0.999 . . . . 1.08 109.585 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -109.41 132.33 54.23 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 106.897 -1.52 . . . . 1.13 106.897 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.2 t -130.28 134.17 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 121.231 -0.918 . . . . 1.03 110.856 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -96.35 120.85 37.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.564 -0.71 . . . . 1.05 109.44 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.4 m -67.81 -19.35 24.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.635 -1.29 . . . . 1.04 108.464 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.9 m-20 -92.24 -43.68 9.17 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.483 -0.761 . . . . 1.08 111.446 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -93.25 -21.87 19.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.535 -1.353 . . . . 1.07 108.355 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.61 38.57 3.57 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 107.982 -1.118 . . . . 1.03 107.982 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -59.83 -22.19 61.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.814 -0.554 . . . . 1.92 109.903 -178.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.519 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -63.93 -38.86 92.63 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.123 -0.986 . . . . 1.05 108.943 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.519 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 12.0 t -72.48 -43.98 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 O-C-N 121.319 -0.863 . . . . 1.1 109.952 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -40.16 75.63 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.564 -0.71 . . . . 1.03 111.118 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -63.02 -32.69 74.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.909 -1.119 . . . . 0.89 108.884 -179.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -39.89 95.64 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.839 -0.8 . . . . 2.06 108.839 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.28 0.52 56.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.601 -0.687 . . . . 1.05 109.872 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 54.52 50.17 16.64 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.273 -0.892 . . . . 2.02 109.718 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.37 131.35 28.88 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 C-N-CA 118.153 -1.419 . . . . 1.05 108.732 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -104.86 -10.48 17.31 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.94 -0.475 . . . . 2.16 110.15 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.93 152.28 15.24 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.834 -1.166 . . . . 1.04 110.915 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -124.99 154.12 71.24 Favored Pre-proline 0 N--CA 1.5 2.07 0 N-CA-C 107.388 -1.338 . . . . 1.04 107.388 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -77.37 144.21 76.97 Favored 'Cis proline' 0 N--CA 1.487 1.107 0 C-N-CA 123.601 -1.416 . . . . 0.19 112.062 -2.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.3 m -129.96 133.87 47.08 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.199 -1.037 . . . . 1.04 108.199 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.425 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 84.1 m-85 -112.46 132.24 55.16 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.356 -0.979 . . . . 0.23 108.356 -179.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -123.15 142.79 50.51 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.285 -0.884 . . . . 0.43 108.976 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -108.17 132.12 53.95 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-O 121.712 0.768 . . . . 0.17 111.395 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -125.77 145.44 50.2 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.239 -0.652 . . . . 0.17 109.239 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.4 ' HZ3' ' HG ' ' A' ' 22' ' ' LEU . 11.9 tttp -147.7 131.44 16.96 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.251 -1.389 . . . . 2.18 107.251 178.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 59.0 mttp 56.22 26.76 10.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.564 -1.273 . . . . 1.8 107.564 -177.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.07 17.46 79.68 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 110.354 -1.098 . . . . 0.23 110.354 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.7 mm-40 -117.93 136.71 53.31 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.47 -1.018 . . . . 2.75 109.869 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -79.41 122.21 26.13 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.119 -0.988 . . . . 2.3 108.457 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 19.0 m -122.82 11.88 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.595 -0.691 . . . . 1.06 111.304 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.26 155.46 15.99 Favored Glycine 0 N--CA 1.496 2.694 0 C-N-CA 118.589 -1.767 . . . . 0.22 111.254 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.512 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.54 148.18 7.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.809 -0.818 . . . . 1.93 109.478 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.512 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.8 p90 -167.05 159.03 12.77 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.353 -0.842 . . . . 0.16 110.05 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.5 p -127.08 161.41 28.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.647 -0.658 . . . . 0.9 109.486 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.77 141.71 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 108.995 -1.642 . . . . 0.12 108.995 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.16 67.12 5.87 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.391 -1.064 . . . . 1.04 110.078 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.1 t-20 -120.25 99.37 6.55 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.355 -0.98 . . . . 1.36 108.355 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -67.82 -32.25 72.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 1.6 111.726 -178.822 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -65.97 -28.07 68.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.594 -1.317 . . . . 1.61 109.643 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.46 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 21.6 ttmt -61.0 -35.26 76.37 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 108.779 -0.822 . . . . 2.02 108.779 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 75.1 mt -59.64 -38.83 82.44 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.101 0.953 . . . . 1.05 108.949 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.413 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 9.6 tp10 -63.23 -43.52 97.83 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 120.109 -0.637 . . . . 2.1 111.53 -177.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.11 -43.64 77.98 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.988 -1.07 . . . . 1.06 111.613 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.08 -40.13 94.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.739 -1.226 . . . . 1.04 109.739 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.0 mt -60.05 -50.02 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.155 -1.054 . . . . 1.04 108.155 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -59.7 -35.3 74.23 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 122.041 0.924 . . . . 1.09 108.588 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -67.89 -39.84 83.59 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.532 -0.73 . . . . 2.21 109.971 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.8 mt -99.99 -0.89 38.42 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.214 -0.929 . . . . 1.05 111.273 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 120.481 -1.387 . . . . 1.08 109.265 -179.599 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.559 -0.534 . . . . 1.89 109.559 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 38.3 mm -128.77 141.05 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 N-CA-C 109.541 -0.54 . . . . 1.03 109.541 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 34.7 m -98.47 127.27 44.33 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.837 -1.542 . . . . 0.19 106.837 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -77.54 139.36 39.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.688 -1.258 . . . . 0.93 110.738 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.432 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 21.1 m95 -74.52 -10.9 60.01 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.122 -0.987 . . . . 0.21 109.253 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.425 -0.797 . . . . 0.49 109.16 179.665 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.1 tptt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 108.881 -0.785 . . . . 2.18 108.881 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -94.71 126.16 39.84 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.898 -1.519 . . . . 0.4 106.898 178.074 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.9 mm -100.19 115.62 41.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 121.341 -0.85 . . . . 1.04 108.743 -179.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -98.55 -1.61 40.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.284 -0.885 . . . . 2.25 110.091 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 7' ' ' SER . . . . . 0.405 ' HG ' ' H ' ' A' ' 10' ' ' ALA . 79.6 p -153.52 157.45 39.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.024 -1.048 . . . . 0.91 111.273 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.536 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 27.8 ttpt -66.74 -31.72 72.55 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.729 -1.211 . . . . 2.18 107.729 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 23.8 m -56.31 -48.11 77.36 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.703 -0.851 . . . . 1.03 108.703 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . 0.405 ' H ' ' HG ' ' A' ' 7' ' ' SER . . . -71.1 -32.33 68.91 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.935 -0.765 . . . . 1.02 108.935 178.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -57.02 -42.86 81.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.887 . . . . 0.15 108.802 -179.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.01 -42.21 89.98 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 109.024 -0.732 . . . . 2.07 109.024 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.04 -38.56 91.28 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.201 0.525 . . . . 1.77 110.913 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.48 -40.53 89.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.059 -1.026 . . . . 1.04 109.176 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.0 mt -60.89 -39.98 91.3 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.412 -0.805 . . . . 1.07 109.412 179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -70.24 -34.66 73.11 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.458 -0.776 . . . . 1.07 110.164 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.2 78.0 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 1.07 110.088 -178.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.44 -32.41 71.34 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.279 -0.888 . . . . 1.03 109.299 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.06 -127.25 27.21 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.197 -1.561 . . . . 0.24 109.197 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -90.79 4.08 52.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.109 -1.23 . . . . 1.07 110.693 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.6 mttm -75.13 148.97 39.21 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.846 -1.159 . . . . 2.03 109.633 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.445 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.01 155.85 19.16 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.333 -1.358 . . . . 1.23 107.333 179.591 . . . . . . . . 3 3 . 1 . 021 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.445 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 47.3 t -145.13 121.77 4.15 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 N-CA-C 107.826 -1.175 . . . . 1.03 107.826 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.2 t -110.29 141.07 26.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 108.062 -1.088 . . . . 1.03 108.062 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.8 t -122.51 121.38 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.337 -0.852 . . . . 1.01 109.199 -179.45 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.569 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.7 t70 -99.34 109.31 21.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.46 -0.775 . . . . 1.05 111.114 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -89.88 104.66 17.2 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.688 -1.597 . . . . 0.73 106.688 176.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.2 m -129.99 144.21 51.21 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.622 -0.881 . . . . 0.84 108.622 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.31 122.39 27.89 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.461 -1.311 . . . . 1.04 107.461 178.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -64.43 -33.13 75.15 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.209 -1.034 . . . . 1.08 108.209 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -71.8 -27.25 62.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.414 -0.803 . . . . 0.29 110.541 179.283 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -82.69 115.82 21.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.981 -1.075 . . . . 0.26 108.549 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.457 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.42 -51.9 54.89 Favored Glycine 0 N--CA 1.484 1.876 0 C-N-CA 120.535 -0.841 . . . . 0.28 111.329 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -52.03 -35.48 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 CA-C-N 118.689 1.245 . . . . 0.5 112.734 -179.153 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.83 -54.83 6.31 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.149 -0.969 . . . . 1.04 110.187 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -61.19 -36.28 79.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.114 -0.991 . . . . 2.12 109.76 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 30.0 ttp -58.1 -27.39 63.65 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.26 -0.9 . . . . 2.66 109.041 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.52 -9.19 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 112.178 0.436 . . . . 1.22 112.178 -179.099 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 30.1 pttt -68.2 -30.45 2.66 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 119.965 -1.709 . . . . 1.44 113.437 -177.545 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.6 Cg_exo -49.83 -37.55 45.63 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 CA-C-N 121.843 1.694 . . . . 0.31 112.826 -178.54 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -68.09 -42.88 79.67 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 117.359 -1.736 . . . . 0.45 106.857 178.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -61.13 -53.64 54.54 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.349 -0.844 . . . . 0.16 109.815 178.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -67.73 -40.4 84.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.35 110.78 -179.622 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 71.2 m -60.44 -39.92 89.24 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.117 -0.989 . . . . 0.77 111.442 -179.611 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.91 -20.2 65.67 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.093 -1.004 . . . . 1.07 110.88 -177.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.7 m -51.28 -39.86 57.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.851 -1.156 . . . . 0.87 109.211 -178.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -81.33 -17.44 49.16 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.246 -0.909 . . . . 2.16 109.588 179.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -76.87 -38.4 53.72 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.273 -1.38 . . . . 2.29 107.273 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -121.21 68.72 0.89 Allowed 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 106.298 -1.742 . . . . 0.95 106.298 177.672 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -63.11 -9.02 9.03 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.707 -0.849 . . . . 0.89 108.707 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -91.14 8.53 35.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.684 -0.635 . . . . 1.13 109.433 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 49.4 t -126.86 147.02 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 107.849 -1.167 . . . . 1.06 107.849 179.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.2 mm -99.53 120.96 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 120.987 -1.071 . . . . 1.04 109.794 -178.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -102.9 123.89 47.38 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.38 -0.825 . . . . 0.13 109.728 179.714 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.438 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.1 mp -111.73 142.06 44.55 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.038 -1.039 . . . . 1.08 110.225 178.633 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.34 133.04 53.64 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 107.498 -1.297 . . . . 1.13 107.498 177.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.8 t -128.99 139.05 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.312 -0.868 . . . . 1.03 111.604 -178.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -102.28 120.04 39.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.135 -0.691 . . . . 1.05 109.135 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -68.13 -18.65 23.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.797 -1.189 . . . . 1.04 108.471 178.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -92.37 -41.53 10.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.387 -0.821 . . . . 1.08 111.608 -178.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -95.93 -15.05 22.62 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.602 -1.311 . . . . 1.07 108.122 179.085 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.64 39.69 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.228 -1.397 . . . . 1.03 107.228 179.031 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -60.98 -20.1 61.95 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.307 0.575 . . . . 1.92 109.48 -178.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.536 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 5.0 p-10 -67.4 -39.95 85.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.261 -0.899 . . . . 1.05 109.653 179.505 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -73.13 -42.55 58.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.659 0.743 . . . . 1.1 109.655 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -39.97 72.62 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.491 -0.756 . . . . 1.03 110.431 -179.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.536 ' HG ' ' N ' ' A' ' 68' ' ' GLU . 98.7 p -60.46 -35.77 76.67 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.096 -1.003 . . . . 0.89 108.766 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.536 ' N ' ' HG ' ' A' ' 67' ' ' SER . 67.0 tt0 -62.41 -39.88 94.7 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.509 -0.745 . . . . 2.06 109.393 179.547 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.06 -1.73 57.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 1.05 111.164 -178.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 54.85 50.02 16.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.078 -1.014 . . . . 2.02 109.391 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.3 t -66.79 131.54 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.881 -1.137 . . . . 1.05 109.188 -178.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -103.95 -10.77 17.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.626 -0.672 . . . . 2.16 110.23 -179.534 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.443 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.24 155.32 20.24 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.829 -1.169 . . . . 1.04 110.434 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -130.1 153.86 81.18 Favored Pre-proline 0 N--CA 1.501 2.077 0 N-CA-C 107.818 -1.178 . . . . 1.04 107.818 179.017 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -75.66 142.56 74.39 Favored 'Cis proline' 0 N--CA 1.496 1.624 0 C-N-CA 123.73 -1.363 . . . . 0.19 113.192 -2.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.443 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -125.71 132.25 52.42 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.147 -1.057 . . . . 1.04 108.147 177.602 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.569 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 89.0 m-85 -108.2 130.64 55.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.742 -0.836 . . . . 0.23 108.742 -179.261 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -122.38 141.25 51.77 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.135 -1.061 . . . . 0.43 108.135 179.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -108.66 132.41 53.94 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.559 0.695 . . . . 0.17 110.643 -178.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -125.95 146.01 50.04 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.497 0.665 . . . . 0.17 109.925 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -149.59 131.14 14.85 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 107.975 -1.12 . . . . 2.18 107.975 179.062 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 57.34 27.52 13.9 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.467 -0.938 . . . . 1.8 108.467 -178.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.96 21.47 76.22 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.887 -1.285 . . . . 0.23 109.887 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -127.79 142.68 51.24 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -1.091 . . . . 2.75 110.043 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.488 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 76.3 tttt -79.96 129.79 34.77 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.014 -1.054 . . . . 2.3 109.166 179.665 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.4 m -123.01 4.6 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.637 -0.665 . . . . 1.06 110.741 -179.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 173.84 161.03 23.25 Favored Glycine 0 N--CA 1.495 2.577 0 C-N-CA 118.218 -1.944 . . . . 0.22 111.844 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.488 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 58.2 tt0 -163.9 151.88 12.88 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.714 -0.874 . . . . 1.93 109.479 179.04 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.538 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 6.7 p90 -166.72 157.15 11.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.435 -0.791 . . . . 0.16 109.781 177.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -127.51 163.05 24.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.812 0.815 . . . . 0.9 110.753 -178.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.63 143.96 7.15 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.208 -1.557 . . . . 0.12 109.208 179.373 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.85 67.14 2.21 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.364 -1.08 . . . . 1.04 110.403 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.2 91.19 3.48 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 108.455 -0.943 . . . . 1.36 108.455 178.197 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.73 72.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.022 -1.048 . . . . 1.6 111.353 -179.162 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -65.29 -29.84 70.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.753 -1.217 . . . . 1.61 109.961 -179.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.538 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 56.1 tttm -60.32 -35.8 76.44 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.374 -0.829 . . . . 2.02 109.296 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.0 mt -58.09 -39.24 78.1 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.738 -0.838 . . . . 1.05 108.738 179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -61.8 -43.67 98.39 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 119.883 -0.727 . . . . 2.1 110.964 -178.407 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.39 -43.23 77.76 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.011 -1.055 . . . . 1.06 111.357 -178.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -64.63 -39.55 93.89 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.824 -1.173 . . . . 1.04 110.158 -178.285 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.44 -48.38 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.126 -0.984 . . . . 1.04 108.428 179.168 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -59.95 -37.05 78.41 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.104 0.954 . . . . 1.09 108.689 179.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -67.33 -38.81 85.51 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.79 -0.569 . . . . 2.21 110.088 -178.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 79.6 mt -100.07 -2.88 33.16 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.918 -1.114 . . . . 1.05 111.367 -179.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.496 1.845 0 O-C-N 120.48 -1.388 . . . . 1.08 109.347 -179.661 . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 109.332 -0.618 . . . . 1.89 109.332 . . . . . . . . . 0 0 . 1 . 021 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 30.7 mm -130.74 141.07 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 N-CA-C 109.497 -0.557 . . . . 1.03 109.497 -179.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 64.9 m -95.91 131.66 42.02 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.518 -1.289 . . . . 0.19 107.518 177.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -80.18 139.32 36.83 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.811 -1.18 . . . . 0.93 111.384 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.408 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.1 m95 -78.03 -9.46 59.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.061 -1.024 . . . . 0.21 108.813 178.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--N 1.304 -1.377 0 O-C-N 121.136 -0.978 . . . . 0.49 108.525 -179.936 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.1 tptp . . . . . 0 N--CA 1.495 1.775 0 N-CA-C 108.185 -1.042 . . . . 2.18 108.185 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -95.06 123.75 38.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.008 -1.058 . . . . 0.4 109.027 179.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.87 111.97 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.513 -0.921 . . . . 1.04 108.513 179.509 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -96.64 -0.2 48.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.168 -0.957 . . . . 2.25 110.212 -179.355 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.43 156.89 36.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.787 -1.196 . . . . 0.91 110.803 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.457 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 33.5 ttmt -64.04 -32.76 74.42 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.8 -1.185 . . . . 2.18 107.8 177.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.9 m -56.13 -48.34 76.43 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.425 -0.91 . . . . 1.03 108.963 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.55 -31.36 70.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.247 -0.908 . . . . 1.02 109.28 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -58.99 -44.66 91.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.15 109.549 -178.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -64.11 -40.99 97.4 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.202 -1.036 . . . . 2.07 108.202 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -65.15 -36.7 85.06 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.562 0.696 . . . . 1.77 110.344 179.401 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.79 -43.84 78.76 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.795 -0.817 . . . . 1.04 108.795 -179.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.6 mt -60.67 -39.5 88.65 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.376 -0.972 . . . . 1.07 108.376 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.01 -32.96 72.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.428 -0.795 . . . . 1.07 109.962 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.2 63.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.13 -0.981 . . . . 1.07 110.539 -179.211 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.52 -30.08 70.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.05 -1.031 . . . . 1.03 109.555 -179.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.9 -127.37 24.96 Favored Glycine 0 N--CA 1.487 2.089 0 N-CA-C 110.08 -1.208 . . . . 0.24 110.08 -179.895 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -92.78 4.24 54.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.362 -1.081 . . . . 1.07 110.44 -179.139 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -75.45 151.33 38.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.172 -0.955 . . . . 2.03 109.388 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.467 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -61.3 156.03 19.78 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 107.54 -1.282 . . . . 1.23 107.54 -179.732 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.467 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 60.7 t -142.69 119.57 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.064 -1.023 . . . . 1.03 108.469 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -105.89 139.82 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 N-CA-C 107.72 -1.215 . . . . 1.03 107.72 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 32.9 t -123.58 120.3 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.151 -0.968 . . . . 1.01 109.295 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.557 ' CG ' ' HG ' ' A' ' 28' ' ' SER . 62.7 t0 -98.53 118.51 35.39 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.375 -0.828 . . . . 1.05 110.079 179.632 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -94.63 24.83 4.34 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.09 -1.007 . . . . 0.73 109.803 179.16 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.557 ' HG ' ' CG ' ' A' ' 26' ' ' ASP . 52.8 m -60.16 147.69 38.86 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.01 -1.056 . . . . 0.84 110.618 -179.011 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.83 124.0 31.09 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.602 -1.259 . . . . 1.04 107.602 178.81 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.4 t -66.96 -29.2 68.99 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 108.098 -1.075 . . . . 1.08 108.098 179.694 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.535 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 63.9 p-90 -75.53 -19.09 59.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.521 -0.737 . . . . 0.29 110.435 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.0 t -87.29 111.7 21.31 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.668 -1.234 . . . . 0.26 107.668 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.71 -50.93 62.42 Favored Glycine 0 N--CA 1.486 1.992 0 C-N-CA 120.557 -0.83 . . . . 0.28 111.379 -178.13 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.78 -35.94 50.07 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 CA-C-N 118.964 1.382 . . . . 0.5 111.234 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.54 -45.11 22.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.378 -0.826 . . . . 1.04 109.826 179.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -59.95 -31.34 69.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.162 -0.961 . . . . 2.12 108.841 179.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.521 ' O ' ' SD ' ' A' ' 37' ' ' MET . 12.2 tmm? -60.37 -29.59 69.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.582 -0.699 . . . . 2.66 109.642 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.5 mt -81.12 -5.56 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.741 -0.6 . . . . 1.22 111.106 -179.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.42 -30.86 7.78 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 119.881 -1.762 . . . . 1.44 112.971 -176.787 . . . . . . . . 3 3 . 1 . 022 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.0 Cg_exo -59.72 -38.46 80.87 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 CA-C-N 121.722 1.651 . . . . 0.31 112.29 -178.529 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -71.43 -50.82 28.01 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.412 -1.315 . . . . 0.45 108.759 179.449 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.7 -48.64 80.88 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.217 -0.927 . . . . 0.16 109.252 179.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -67.5 -44.74 77.75 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.681 -0.637 . . . . 0.35 110.969 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 63.4 m -62.13 -36.42 81.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.953 -1.092 . . . . 0.77 110.35 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 mt -60.13 -26.12 66.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.198 -0.939 . . . . 1.07 110.477 -178.631 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.5 m -53.45 -41.79 66.5 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.79 -1.194 . . . . 0.87 108.428 -179.495 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.415 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 39.9 mp0 -86.06 -16.86 36.79 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.299 -0.876 . . . . 2.16 110.049 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -78.03 -37.22 47.39 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 106.516 -1.661 . . . . 2.29 106.516 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -123.12 70.03 1.02 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.266 -1.383 . . . . 0.95 107.266 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.6 p -65.67 -7.83 17.42 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.835 -0.802 . . . . 0.89 108.835 -179.498 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -88.47 3.9 48.47 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.685 -0.857 . . . . 1.13 108.685 179.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.7 t -126.4 145.56 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.562 -1.273 . . . . 1.06 107.562 178.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mm -98.67 121.86 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.045 . . . . 1.04 109.574 -178.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -102.63 123.86 47.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.24 -0.912 . . . . 0.13 109.747 179.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.47 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.9 mp -110.39 140.16 44.89 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.266 -0.896 . . . . 1.08 109.696 178.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -109.98 130.0 55.59 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 106.831 -1.544 . . . . 1.13 106.831 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.9 136.72 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 CA-C-O 121.51 0.671 . . . . 1.03 110.474 -178.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -98.92 121.69 41.2 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 1.05 109.729 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -68.31 -17.49 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 120.98 -1.075 . . . . 1.04 108.702 179.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.7 m-20 -94.48 -41.99 9.08 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.525 -0.735 . . . . 1.08 111.591 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -96.91 -13.86 22.16 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.644 -1.285 . . . . 1.07 108.476 179.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.63 37.88 4.31 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.052 -1.462 . . . . 1.03 107.052 179.6 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.28 -21.85 62.43 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.972 -0.751 . . . . 1.92 108.972 -178.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.457 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 2.6 p30 -64.86 -39.64 93.87 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.134 -0.979 . . . . 1.05 108.964 179.215 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.5 t -73.59 -44.13 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.394 -0.816 . . . . 1.1 109.781 -179.65 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.27 72.03 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.381 -0.824 . . . . 1.03 110.71 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.8 p -61.2 -32.86 72.62 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.998 -1.064 . . . . 0.89 109.091 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -64.65 -39.92 94.54 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.488 -0.757 . . . . 2.06 110.19 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.81 1.66 53.34 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.292 -0.88 . . . . 1.05 110.677 -178.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 55.79 49.64 15.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.02 109.58 -179.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.77 130.65 30.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 C-N-CA 118.468 -1.293 . . . . 1.05 108.373 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -104.53 -10.8 17.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.628 -0.67 . . . . 2.16 109.968 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.78 155.85 22.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.9 -1.125 . . . . 1.04 110.991 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.68 156.26 79.08 Favored Pre-proline 0 N--CA 1.498 1.974 0 N-CA-C 107.819 -1.178 . . . . 1.04 107.819 179.087 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -76.06 139.67 61.78 Favored 'Cis proline' 0 N--CA 1.497 1.681 0 C-N-CA 123.969 -1.263 . . . . 0.19 112.611 -2.489 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -124.43 135.63 53.41 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 108.772 -0.825 . . . . 1.04 108.772 178.391 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -113.12 131.75 55.71 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 109.121 -0.696 . . . . 0.23 109.121 -179.572 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -122.09 140.09 52.93 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.139 -1.06 . . . . 0.43 108.139 178.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -107.65 133.41 52.12 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.775 -0.578 . . . . 0.17 110.198 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -126.23 148.65 49.43 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.013 -0.736 . . . . 0.17 109.013 179.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -148.58 126.82 12.17 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 107.644 -1.243 . . . . 2.18 107.644 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.1 mttp 57.63 25.23 11.42 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.704 -1.221 . . . . 1.8 107.704 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.5 16.88 77.03 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 110.096 -1.202 . . . . 0.23 110.096 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -116.23 135.67 53.7 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.482 -1.011 . . . . 2.75 109.964 -179.628 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.503 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 80.9 tttt -81.54 122.5 27.65 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.307 -0.997 . . . . 2.3 108.307 178.32 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.3 m -123.29 9.87 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.648 -0.658 . . . . 1.06 110.811 -179.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.56 151.67 9.72 Favored Glycine 0 N--CA 1.499 2.885 0 C-N-CA 118.184 -1.96 . . . . 0.22 112.201 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.503 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 67.9 tt0 -164.48 151.22 11.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.684 -0.892 . . . . 1.93 109.341 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 21.5 p90 -163.21 161.27 24.82 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.768 -0.827 . . . . 0.16 108.768 177.423 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -125.92 160.05 30.97 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.554 0.692 . . . . 0.9 110.059 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.76 141.97 5.8 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.851 -1.699 . . . . 0.12 108.851 179.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.73 65.28 4.85 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.101 -1.235 . . . . 1.04 109.818 -179.553 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.9 t-20 -119.46 100.21 7.15 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.142 -1.058 . . . . 1.36 108.142 178.538 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -32.36 72.63 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.346 -0.846 . . . . 1.6 111.538 -179.026 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.48 -29.55 70.22 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.968 -1.082 . . . . 1.61 109.812 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.502 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 78.2 tttt -60.18 -38.28 82.75 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.982 -0.748 . . . . 2.02 108.982 -179.153 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 44.1 mt -57.14 -39.43 75.17 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.993 0.902 . . . . 1.05 108.743 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -61.66 -41.99 98.29 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 120.074 -0.65 . . . . 2.1 110.632 -177.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.41 -44.09 75.78 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.261 -0.899 . . . . 1.06 111.227 -179.095 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.2 m -66.16 -40.01 90.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.899 -1.126 . . . . 1.04 109.903 -178.445 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -60.92 -49.73 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 107.987 -1.116 . . . . 1.04 107.987 178.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.95 -35.35 74.76 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.853 0.835 . . . . 1.09 108.752 178.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -67.19 -39.99 86.46 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.715 -0.616 . . . . 2.21 110.019 -178.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.0 mt -100.25 -1.87 35.26 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.316 -0.865 . . . . 1.05 111.206 -178.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 N--CA 1.498 1.974 0 O-C-N 120.554 -1.341 . . . . 1.08 109.269 -179.64 . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.539 -0.541 . . . . 1.89 109.539 . . . . . . . . . 0 0 . 1 . 022 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 30.3 mm -131.72 141.86 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 121.672 -0.642 . . . . 1.03 109.527 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -101.73 126.5 48.6 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 107.688 -1.227 . . . . 0.19 107.688 177.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -76.97 144.35 38.82 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.988 -1.07 . . . . 0.93 110.813 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.441 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.5 m95 -79.47 -17.04 55.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.334 -0.854 . . . . 0.21 109.44 179.409 . . . . . . . . 2 2 . 1 . 022 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--N 1.302 -1.477 0 N-CA-C 107.868 -1.16 . . . . 0.49 107.868 179.369 . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 18.4 tptp . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 107.787 -1.19 . . . . 2.18 107.787 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -96.13 121.97 38.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.16 -0.963 . . . . 0.4 108.882 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.412 HG22 HD11 ' A' ' 5' ' ' ILE . 25.2 mm -102.21 117.5 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 107.793 -1.188 . . . . 1.04 107.793 179.379 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.7 mp0 -99.38 -0.75 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.921 -1.112 . . . . 2.25 109.993 -178.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.83 158.11 38.91 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.973 -1.079 . . . . 0.91 110.942 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -63.1 -32.79 74.25 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.467 -0.938 . . . . 2.18 108.467 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.0 m -57.65 -47.89 81.0 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.114 -0.991 . . . . 1.03 108.811 -179.484 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.18 -31.15 70.49 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.253 -0.905 . . . . 1.02 108.694 178.551 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -59.4 -43.86 92.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.15 108.655 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -66.05 -41.81 90.33 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.912 -0.773 . . . . 2.07 108.912 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -65.52 -35.68 81.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 1.77 110.307 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.04 -41.35 77.78 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.13 -0.982 . . . . 1.04 109.268 -179.406 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.7 mt -61.09 -39.9 91.67 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.192 -0.943 . . . . 1.07 108.549 179.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.17 -35.39 76.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.651 -0.655 . . . . 1.07 109.999 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.54 -35.85 75.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.293 -0.88 . . . . 1.07 110.486 -179.142 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.63 75.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.082 -1.011 . . . . 1.03 109.867 -179.72 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.07 -126.11 22.75 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.882 -1.287 . . . . 0.24 109.882 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -90.96 3.48 54.53 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.035 -1.273 . . . . 1.07 110.269 -178.886 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mttt -75.4 150.43 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.858 -1.151 . . . . 2.03 109.111 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.481 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.76 159.07 11.58 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 107.244 -1.391 . . . . 1.23 107.244 179.573 . . . . . . . . 3 3 . 1 . 023 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.481 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 94.2 t -145.66 120.06 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.87 -1.144 . . . . 1.03 108.712 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.9 t -108.35 142.6 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 107.955 -1.128 . . . . 1.03 107.955 179.551 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.7 118.76 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.189 -0.944 . . . . 1.01 109.157 -179.273 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.555 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 31.8 t70 -97.33 120.31 37.45 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.36 -0.837 . . . . 1.05 109.852 179.082 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -96.7 24.06 6.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.237 -0.914 . . . . 0.73 110.024 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.8 m -57.48 141.94 45.87 Favored 'General case' 0 C--N 1.294 -1.812 0 O-C-N 121.233 -0.917 . . . . 0.84 110.55 -178.243 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.65 125.52 30.67 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.671 -1.233 . . . . 1.04 107.671 179.138 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.72 -33.34 74.7 Favored 'General case' 0 C--N 1.295 -1.796 0 C-N-CA 118.94 -1.104 . . . . 1.08 108.342 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.542 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 67.6 p-90 -70.48 -24.23 62.82 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.669 . . . . 0.29 110.902 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.93 123.11 29.62 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.565 -1.272 . . . . 0.26 107.565 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.462 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.58 -51.82 39.18 Favored Glycine 0 N--CA 1.489 2.179 0 C-N-CA 120.27 -0.967 . . . . 0.28 111.235 -178.087 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -53.44 -33.87 69.12 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 CA-C-N 118.524 1.162 . . . . 0.5 111.443 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.52 -53.98 7.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.471 -0.768 . . . . 1.04 110.166 -179.896 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -60.08 -36.94 78.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.061 -1.024 . . . . 2.12 109.76 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.498 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -60.15 -30.95 69.64 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.232 -0.917 . . . . 2.66 109.917 -179.11 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.419 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 70.0 mt -81.38 -4.5 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.863 -0.523 . . . . 1.22 111.324 -179.335 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.1 ptmt -64.85 -28.79 3.05 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 120.558 -1.339 . . . . 1.44 113.567 -177.179 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.8 Cg_exo -55.62 -39.64 89.93 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 CA-C-N 121.952 1.733 . . . . 0.31 113.22 -176.316 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -68.14 -44.61 75.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.815 -1.554 . . . . 0.45 108.319 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.33 -54.82 41.06 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.409 -0.807 . . . . 0.16 110.405 178.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -67.65 -41.14 84.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.494 -0.754 . . . . 0.35 110.939 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 64.1 m -62.14 -36.48 81.93 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.0 -1.063 . . . . 0.77 110.91 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -63.87 -19.37 65.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.214 -0.929 . . . . 1.07 110.04 -178.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -53.05 -39.53 63.32 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.91 -1.144 . . . . 0.87 107.91 -179.533 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 35.5 mp0 -82.96 -16.41 47.43 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.375 -0.828 . . . . 2.16 109.397 179.154 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -76.91 -39.0 52.39 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.513 -1.292 . . . . 2.29 107.513 179.166 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -123.7 67.81 1.03 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.3 -1.37 . . . . 0.95 107.3 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.2 p -62.89 -9.08 8.42 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.876 -0.787 . . . . 0.89 108.876 -179.467 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -90.13 6.91 40.52 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.288 -1.004 . . . . 1.13 108.288 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.2 t -125.05 145.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.041 -1.096 . . . . 1.06 108.041 179.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.5 mm -99.96 122.83 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 120.956 -1.09 . . . . 1.04 109.476 -178.549 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -102.95 126.95 50.33 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.13 109.992 179.731 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.2 mp -111.32 139.98 46.27 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.128 -0.983 . . . . 1.08 109.717 178.861 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -110.2 130.11 55.6 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 107.086 -1.45 . . . . 1.13 107.086 178.124 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.2 t -127.76 136.25 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.401 -0.812 . . . . 1.03 110.533 -177.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -98.69 120.34 38.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.363 -0.836 . . . . 1.05 108.95 179.507 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -66.74 -18.25 23.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 120.479 -1.388 . . . . 1.04 108.209 179.36 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 18.8 m-20 -93.8 -44.0 8.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.279 -0.888 . . . . 1.08 111.545 -179.097 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -93.95 -13.49 27.01 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.537 -1.352 . . . . 1.07 108.423 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.24 38.38 4.19 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.578 -1.267 . . . . 1.03 107.578 179.518 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -59.9 -23.85 63.82 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.854 -0.528 . . . . 1.92 109.882 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.532 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -66.49 -38.26 86.87 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.034 -1.041 . . . . 1.05 108.984 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.532 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 16.2 t -69.95 -43.96 78.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.308 -0.87 . . . . 1.1 109.573 179.868 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 -36.33 64.0 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.449 -0.782 . . . . 1.03 111.235 -178.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 67' ' ' SER . . . . . 0.532 ' HG ' ' N ' ' A' ' 68' ' ' GLU . 89.2 p -60.12 -37.73 80.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.773 -1.204 . . . . 0.89 109.428 -179.41 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.532 ' N ' ' HG ' ' A' ' 67' ' ' SER . 15.2 tm-20 -63.25 -38.13 89.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 2.06 109.526 179.327 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.44 -3.63 58.91 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.448 -0.782 . . . . 1.05 110.313 -178.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mp0 54.74 49.61 17.6 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.373 -0.829 . . . . 2.02 109.232 -179.584 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.77 132.21 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 120.846 -1.159 . . . . 1.05 108.576 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -103.48 -11.92 17.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.582 -0.699 . . . . 2.16 110.813 -178.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.517 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.97 156.26 24.53 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.751 -1.218 . . . . 1.04 110.596 -179.442 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -128.5 153.36 79.31 Favored Pre-proline 0 N--CA 1.497 1.888 0 N-CA-C 107.455 -1.313 . . . . 1.04 107.455 178.139 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -76.85 140.47 65.27 Favored 'Cis proline' 0 N--CA 1.488 1.205 0 C-N-CA 123.617 -1.409 . . . . 0.19 112.405 -2.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.517 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.0 m -124.91 132.64 53.27 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.934 -1.136 . . . . 1.04 107.934 177.475 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.555 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.0 m-85 -111.13 132.02 54.63 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.444 -0.947 . . . . 0.23 108.444 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -122.23 143.12 49.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.275 -0.89 . . . . 0.43 108.612 179.463 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -109.12 132.68 53.89 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.525 0.679 . . . . 0.17 110.581 -178.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -127.53 147.29 50.32 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.473 0.654 . . . . 0.17 109.341 179.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -148.9 126.35 11.6 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.74 -1.207 . . . . 2.18 107.74 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.3 mttp 59.86 28.42 17.91 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.518 -0.739 . . . . 1.8 109.072 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.89 19.95 71.72 Favored Glycine 0 N--CA 1.489 2.198 0 O-C-N 121.101 -0.999 . . . . 0.23 111.095 179.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -130.46 145.13 51.78 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.045 -1.268 . . . . 2.75 109.94 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -79.87 126.86 31.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.287 -0.883 . . . . 2.3 109.636 179.663 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.6 m -121.63 6.04 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.737 -0.602 . . . . 1.06 110.126 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.81 157.03 21.09 Favored Glycine 0 N--CA 1.494 2.51 0 C-N-CA 118.716 -1.707 . . . . 0.22 111.454 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.453 ' OE2' ' CG2' ' A' ' 76' ' ' THR . 2.3 tp10 -164.95 147.46 8.22 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.518 -0.919 . . . . 1.93 108.518 179.367 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.46 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 4.3 p90 -169.4 155.87 6.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.665 -0.814 . . . . 0.16 109.213 177.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.4 p -126.17 162.77 24.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.688 -0.633 . . . . 0.9 110.024 -179.015 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.65 140.29 5.83 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.06 -1.616 . . . . 0.12 109.06 179.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.26 64.09 2.0 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.286 -1.126 . . . . 1.04 110.537 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.3 t-20 -118.85 100.0 7.11 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.376 -0.972 . . . . 1.36 108.376 178.018 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -30.12 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.328 -0.857 . . . . 1.6 111.641 -179.107 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -66.64 -29.85 69.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.875 -1.14 . . . . 1.61 109.76 -179.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 52.4 tttp -61.82 -33.92 75.01 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 109.043 -0.725 . . . . 2.02 109.043 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.48 -39.98 85.48 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.707 -0.849 . . . . 1.05 108.707 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.9 -43.96 97.38 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.232 -0.987 . . . . 2.1 110.854 -178.363 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.78 77.84 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.187 -0.946 . . . . 1.06 111.076 -178.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 19.6 m -64.74 -39.95 94.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.736 -1.228 . . . . 1.04 108.189 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.429 ' O ' ' N ' ' A' ' 105' ' ' VAL . 74.1 mt -65.29 -47.13 88.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 107.671 -1.233 . . . . 1.04 107.671 178.397 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.52 -35.47 76.06 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.657 -1.238 . . . . 1.09 107.657 179.562 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -69.98 -39.23 76.05 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 116.022 -0.535 . . . . 2.21 110.143 -179.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.6 mt -98.34 -4.45 34.92 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.061 -1.025 . . . . 1.05 111.398 -178.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.429 ' N ' ' O ' ' A' ' 101' ' ' ILE . 9.3 p . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.485 -1.385 . . . . 1.08 109.143 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm . . . . . 0 N--CA 1.5 2.029 0 N-CA-C 109.578 -0.527 . . . . 1.89 109.578 . . . . . . . . . 0 0 . 1 . 023 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 33.2 mm -130.42 142.49 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 121.855 -0.528 . . . . 1.03 109.721 -179.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 22.2 m -98.49 131.97 44.31 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 107.407 -1.331 . . . . 0.19 107.407 177.57 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.4 m -81.02 139.38 35.79 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.851 -1.155 . . . . 0.93 111.244 -178.2 . . . . . . . . 1 1 . 1 . 023 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.412 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.9 m95 -77.19 -18.28 57.87 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.292 -0.88 . . . . 0.21 109.409 178.882 . . . . . . . . 2 2 . 1 . 023 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . 0.455 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.8 m120 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 108.123 -1.066 . . . . 0.49 108.123 179.354 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm . . . . . 0 N--CA 1.498 1.969 0 N-CA-C 109.205 -0.665 . . . . 2.18 109.205 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -93.37 125.16 37.82 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.742 -0.836 . . . . 0.4 108.742 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mm -99.86 113.59 35.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 N-CA-C 108.422 -0.955 . . . . 1.04 108.422 179.402 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -99.13 -1.04 40.42 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.116 -0.99 . . . . 2.25 109.915 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.3 p -155.38 154.51 32.09 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.108 -0.995 . . . . 0.91 110.999 -179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 ttpp -61.49 -33.96 74.68 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.926 -1.138 . . . . 2.18 107.926 178.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 42.1 m -57.55 -44.12 84.95 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.32 -0.952 . . . . 1.03 108.555 -179.446 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.31 69.54 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.25 -0.906 . . . . 1.02 109.037 178.476 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -59.73 -43.2 94.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.257 -0.902 . . . . 0.15 109.028 -179.189 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -66.18 -40.52 90.53 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.688 -0.856 . . . . 2.07 108.688 179.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -64.64 -40.93 96.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.292 0.567 . . . . 1.77 110.562 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.9 -40.9 83.37 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.309 -0.869 . . . . 1.04 108.907 -178.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.89 -40.03 91.5 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.343 -0.984 . . . . 1.07 108.343 179.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -69.99 -34.37 73.25 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.416 -0.803 . . . . 1.07 109.834 179.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.99 76.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.225 -0.922 . . . . 1.07 109.926 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.97 74.9 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 1.03 109.025 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.61 18.62 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.879 -1.288 . . . . 0.24 109.879 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -90.19 3.3 53.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.133 -1.216 . . . . 1.07 110.747 -179.053 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mtpt -77.06 149.99 35.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 2.03 109.51 -179.686 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.457 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.9 155.49 19.64 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.082 -1.081 . . . . 1.23 108.082 -179.39 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.457 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 87.6 t -144.35 112.42 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.012 -1.055 . . . . 1.03 109.131 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -99.6 141.9 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.168 -1.049 . . . . 1.03 108.168 179.583 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.98 122.34 63.11 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.217 -0.927 . . . . 1.01 110.196 -178.542 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -99.24 122.94 43.09 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.646 -0.658 . . . . 1.05 109.775 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -99.26 18.54 17.33 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.264 -0.898 . . . . 0.73 109.925 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.5 m -52.05 147.87 6.82 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-O 122.063 0.935 . . . . 0.84 110.618 -178.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.76 123.9 31.66 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.444 -1.317 . . . . 1.04 107.444 178.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.77 -28.96 68.81 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.195 -1.002 . . . . 1.08 108.332 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.546 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 68.4 p-90 -78.02 -15.82 58.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.496 -0.753 . . . . 0.29 110.977 -179.515 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.7 t -88.22 116.55 26.5 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.877 -1.139 . . . . 0.26 108.04 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.409 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.37 -53.56 44.53 Favored Glycine 0 N--CA 1.489 2.193 0 C-N-CA 120.081 -1.057 . . . . 0.28 111.256 -178.521 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.409 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.99 -35.99 52.16 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.949 1.375 . . . . 0.5 111.612 179.895 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.92 -48.81 17.14 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.438 -0.789 . . . . 1.04 109.662 -179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.04 -37.81 80.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 2.12 109.47 179.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 33.0 tpp -59.12 -27.48 65.64 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.517 -0.74 . . . . 2.66 109.27 -179.393 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.435 ' CG2' ' O ' ' A' ' 38' ' ' ILE . 96.6 mt -80.94 -4.08 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.971 -0.456 . . . . 1.22 111.368 -179.772 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.536 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.08 5.83 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 120.283 -1.51 . . . . 1.44 113.916 -178.028 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.536 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 30.5 Cg_exo -58.89 -41.42 62.47 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 121.675 1.634 . . . . 0.31 112.379 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . 0.634 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 35.4 m-85 -69.13 -50.21 50.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.693 -1.255 . . . . 0.45 109.547 179.513 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -59.96 -50.82 72.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.027 -1.045 . . . . 0.16 109.447 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -67.54 -40.01 85.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.891 -0.506 . . . . 0.35 110.69 -179.423 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.49 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -63.29 -39.22 93.97 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.957 -1.089 . . . . 0.77 111.085 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.01 -23.43 63.67 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.194 -0.941 . . . . 1.07 110.203 -178.212 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.2 m -52.0 -40.15 60.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 118.72 -1.192 . . . . 0.87 108.765 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -82.82 -16.68 46.77 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.454 -0.779 . . . . 2.16 109.366 179.303 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -75.68 -37.44 59.55 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 107.362 -1.347 . . . . 2.29 107.362 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -124.75 68.71 1.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.077 -1.453 . . . . 0.95 107.077 177.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.4 p -62.28 -9.73 8.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.727 -0.842 . . . . 0.89 108.727 -179.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -91.92 9.84 31.29 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.644 -0.872 . . . . 1.13 108.644 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.8 t -127.58 144.82 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 107.639 -1.245 . . . . 1.06 107.639 178.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.2 mm -99.99 122.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.269 -0.895 . . . . 1.04 109.599 -178.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -103.06 126.81 50.41 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 108.692 -0.855 . . . . 0.13 108.692 179.25 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.442 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 4.0 mp -110.0 142.11 41.86 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.19 -0.944 . . . . 1.08 109.134 179.803 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -110.68 130.68 55.51 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 106.778 -1.564 . . . . 1.13 106.778 178.073 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.73 131.9 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.436 -0.79 . . . . 1.03 110.113 -178.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.403 ' O ' ' N ' ' A' ' 62' ' ' ALA . 45.6 t0 -96.1 119.89 35.4 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.518 -0.739 . . . . 1.05 109.599 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -67.98 -14.91 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.42 -1.425 . . . . 1.04 108.658 179.438 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.546 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 14.1 m-20 -94.45 -44.07 8.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.425 -0.797 . . . . 1.08 111.353 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -96.75 -18.63 19.49 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 120.776 -1.202 . . . . 1.07 108.836 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -119.03 36.59 4.4 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.346 -1.353 . . . . 1.03 107.346 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.579 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.4 OUTLIER -60.16 -23.55 64.03 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.961 -0.563 . . . . 1.92 110.277 -178.905 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -67.09 -35.43 79.77 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.001 -1.062 . . . . 1.05 108.633 179.5 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.6 t -73.36 -43.95 55.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.501 -0.749 . . . . 1.1 109.158 179.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.27 -40.77 74.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.393 -0.817 . . . . 1.03 110.957 -178.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.7 p -61.81 -32.71 73.04 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.71 -1.244 . . . . 0.89 109.287 -179.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -62.95 -38.16 89.97 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.282 -0.886 . . . . 2.06 109.075 179.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.54 2.04 55.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.558 -0.714 . . . . 1.05 111.081 -178.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 54.39 49.89 17.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.888 -1.133 . . . . 2.02 109.935 179.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.2 t -64.8 132.57 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 120.801 -1.187 . . . . 1.05 109.224 -179.114 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.95 -14.03 16.12 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.812 . . . . 2.16 110.056 -179.351 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.0 157.49 21.0 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.881 -1.137 . . . . 1.04 111.031 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -128.79 155.46 79.29 Favored Pre-proline 0 N--CA 1.499 1.99 0 N-CA-C 107.326 -1.361 . . . . 1.04 107.326 178.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -76.26 139.98 63.26 Favored 'Cis proline' 0 N--CA 1.49 1.288 0 C-N-CA 123.667 -1.389 . . . . 0.19 112.263 -2.178 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 99.1 m -124.56 139.53 53.79 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.491 -0.929 . . . . 1.04 108.491 178.038 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.471 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 95.4 m-85 -115.66 130.2 56.77 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.724 -0.843 . . . . 0.23 108.724 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -123.45 141.86 51.58 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.577 -0.897 . . . . 0.43 108.577 179.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 59.2 m-85 -108.37 137.25 46.65 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.528 0.68 . . . . 0.17 110.333 -179.229 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -129.91 147.31 51.66 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.377 0.608 . . . . 0.17 109.44 179.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -148.05 124.31 10.87 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.253 -1.388 . . . . 2.18 107.253 179.371 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 59.83 29.42 18.98 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.136 -1.061 . . . . 1.8 108.136 -178.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.59 15.23 81.72 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.611 -1.396 . . . . 0.23 109.611 -179.39 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.4 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.8 mm-40 -115.58 133.83 55.65 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.432 -1.04 . . . . 2.75 110.515 -179.222 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -78.68 124.38 28.13 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.27 -1.011 . . . . 2.3 108.27 178.217 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.7 m -123.93 9.14 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.558 -0.714 . . . . 1.06 110.968 -179.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.86 152.58 10.94 Favored Glycine 0 N--CA 1.498 2.816 0 C-N-CA 118.616 -1.754 . . . . 0.22 111.454 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -165.37 147.77 7.79 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.697 -0.884 . . . . 1.93 109.765 179.377 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -163.94 162.03 23.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 119.305 -0.958 . . . . 0.16 109.333 177.072 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -125.4 160.36 29.61 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.515 0.674 . . . . 0.9 109.551 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.03 141.02 5.95 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.907 -1.677 . . . . 0.12 108.907 179.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.15 66.31 2.28 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.256 -1.144 . . . . 1.04 109.168 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.81 92.17 3.72 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.413 -0.804 . . . . 1.36 109.073 179.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.634 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.5 OUTLIER -68.08 -32.17 72.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.081 -1.012 . . . . 1.6 111.422 -179.791 . . . . . . . . 3 3 . 1 . 024 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -62.68 -30.13 71.17 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.81 -1.181 . . . . 1.61 109.075 -179.165 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -61.05 -35.66 77.53 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 109.115 -0.698 . . . . 2.02 109.115 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.68 -39.35 84.24 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-O 122.013 0.911 . . . . 1.05 108.892 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.09 -42.89 99.34 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.846 -0.742 . . . . 2.1 110.502 -177.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.97 -44.02 73.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 1.06 111.399 -178.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.9 m -66.3 -39.87 89.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.903 -1.123 . . . . 1.04 110.004 -178.499 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.68 -50.04 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.819 -1.178 . . . . 1.04 107.819 178.715 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -60.01 -34.91 73.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.507 -0.923 . . . . 1.09 108.507 178.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -68.02 -40.04 83.02 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.581 -0.7 . . . . 2.21 110.368 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.2 mt -99.46 -2.03 37.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.32 -0.862 . . . . 1.05 111.451 -178.656 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.498 1.965 0 O-C-N 120.568 -1.333 . . . . 1.08 109.298 179.935 . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.614 -0.513 . . . . 1.89 109.614 . . . . . . . . . 0 0 . 1 . 024 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 33.2 mm -131.9 142.06 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.776 -0.577 . . . . 1.03 109.89 -179.101 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 17.9 m -99.7 125.26 45.54 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.937 -1.505 . . . . 0.19 106.937 177.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 69.5 m -77.99 140.89 39.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.897 -1.127 . . . . 0.93 110.386 -178.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 22.1 m95 -75.06 -10.13 59.18 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.183 -0.948 . . . . 0.21 109.252 179.785 . . . . . . . . 1 1 . 1 . 024 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.334 -0.854 . . . . 0.49 108.862 179.784 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 tptm . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 108.355 -0.98 . . . . 2.18 108.355 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -98.66 124.97 43.79 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.246 -0.909 . . . . 0.4 108.727 178.667 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.1 mm -103.38 113.28 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.551 -0.907 . . . . 1.04 108.551 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -98.26 0.0 44.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.316 -0.865 . . . . 2.25 110.04 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -151.63 155.42 38.35 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.042 -1.036 . . . . 0.91 111.217 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.414 ' HZ3' ' HB3' ' A' ' 8' ' ' LYS . 9.8 ttpp -64.82 -31.87 73.3 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.491 -0.929 . . . . 2.18 108.491 178.321 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 93.5 m -57.44 -49.82 75.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.996 . . . . 1.03 109.465 -179.472 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.95 -29.58 67.84 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 119.416 -0.914 . . . . 1.02 108.863 179.015 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -59.78 -44.04 94.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.177 -0.952 . . . . 0.15 109.518 179.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -64.74 -43.08 94.5 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.542 -0.91 . . . . 2.07 108.542 -179.788 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.04 -37.5 87.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.762 -0.586 . . . . 1.77 110.171 179.468 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.48 -41.26 84.87 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.089 -1.007 . . . . 1.04 108.949 -179.089 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.4 mt -60.24 -39.85 88.17 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.188 -0.945 . . . . 1.07 108.828 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.55 -36.3 76.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.53 -0.731 . . . . 1.07 110.335 -179.555 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.39 -35.93 76.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.316 -0.865 . . . . 1.07 110.512 -178.725 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.35 -30.95 71.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.106 -0.996 . . . . 1.03 109.301 -179.697 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.22 -125.85 24.88 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.465 -1.454 . . . . 0.24 109.465 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -92.17 5.16 51.42 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.294 -1.121 . . . . 1.07 110.729 -179.304 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.69 148.88 40.16 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.79 -1.194 . . . . 2.03 108.947 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.629 ' N ' ' HZ1' ' A' ' 81' ' ' LYS . 0.6 OUTLIER -59.82 159.82 8.42 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 106.638 -1.616 . . . . 1.23 106.638 -179.973 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.497 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 78.8 t -147.35 111.06 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 120.75 -1.219 . . . . 1.03 108.937 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -101.34 144.16 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.255 -1.017 . . . . 1.03 108.255 179.526 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.2 t -126.66 121.66 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.333 -0.854 . . . . 1.01 109.52 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.7 t70 -99.28 119.94 38.74 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.284 -0.885 . . . . 1.05 110.051 179.499 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -95.52 21.96 7.62 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.145 -0.972 . . . . 0.73 109.645 178.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.403 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 52.9 m -55.81 147.86 18.05 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.818 -1.176 . . . . 0.84 110.305 -178.587 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.56 126.59 34.58 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.174 -1.047 . . . . 1.04 108.174 179.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -67.91 -30.21 69.48 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.207 -0.997 . . . . 1.08 109.191 -179.462 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 59.2 p-90 -75.79 -18.06 59.64 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.076 -1.05 . . . . 0.29 110.15 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.0 t -83.8 121.64 27.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.979 -1.075 . . . . 0.26 108.402 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.39 -55.03 28.01 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 121.518 -0.739 . . . . 0.28 112.534 -178.005 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.8 Cg_endo -60.7 -29.93 89.35 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 119.412 1.606 . . . . 0.5 112.09 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.61 -49.76 20.41 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.118 -1.067 . . . . 1.04 108.118 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.37 -32.35 71.21 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.158 -1.053 . . . . 2.12 108.158 177.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -57.88 -28.04 63.82 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.007 -0.542 . . . . 2.66 110.112 -179.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.9 mt -85.25 -0.92 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.458 -0.776 . . . . 1.22 111.573 -178.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.74 -30.75 6.84 Favored Pre-proline 0 C--N 1.302 -1.497 0 O-C-N 120.263 -1.523 . . . . 1.44 113.045 -178.768 . . . . . . . . 3 3 . 1 . 025 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.7 Cg_exo -59.7 -44.21 33.04 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 121.542 1.586 . . . . 0.31 112.91 -178.124 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -69.54 -45.38 68.93 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 118.36 -1.336 . . . . 0.45 108.948 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -61.31 -52.29 65.32 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.988 -1.07 . . . . 0.16 109.701 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -68.07 -42.49 80.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.536 -0.727 . . . . 0.35 111.548 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.1 m -62.74 -39.87 95.46 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.882 -1.136 . . . . 0.77 110.79 -179.202 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.5 mt -61.32 -23.78 65.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.331 -0.856 . . . . 1.07 110.755 -178.338 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.8 m -54.27 -35.32 62.41 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.094 -1.004 . . . . 0.87 109.009 -178.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -88.3 -13.0 41.92 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.082 -1.011 . . . . 2.16 108.734 179.183 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -80.52 -37.51 31.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.445 -1.317 . . . . 2.29 107.445 178.408 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.438 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 72.7 m-85 -121.9 68.2 0.92 Allowed 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.986 -1.487 . . . . 0.95 106.986 178.138 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.1 p -64.01 -9.71 17.49 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 108.492 -0.929 . . . . 0.89 108.492 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -90.47 7.73 37.42 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.312 -0.996 . . . . 1.13 108.312 178.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 45.7 t -127.23 143.32 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 107.415 -1.328 . . . . 1.06 107.415 178.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.1 mm -99.78 124.13 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.097 -1.002 . . . . 1.04 109.501 -178.516 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -104.15 127.31 51.74 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.333 -0.855 . . . . 0.13 109.503 179.188 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.46 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.6 mp -110.42 139.86 45.21 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.3 -0.875 . . . . 1.08 109.218 178.239 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -110.06 130.34 55.55 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 106.982 -1.488 . . . . 1.13 106.982 178.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.4 t -128.28 134.04 65.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.354 -0.841 . . . . 1.03 110.74 -177.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -95.86 119.43 34.34 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.011 -0.737 . . . . 1.05 109.011 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.23 -16.38 20.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.476 -1.39 . . . . 1.04 108.39 179.223 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.85 -41.47 9.62 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 1.08 111.261 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -95.74 -22.2 17.68 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.844 -1.16 . . . . 1.07 108.747 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.46 39.92 3.34 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.866 -1.161 . . . . 1.03 107.866 179.534 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -60.08 -22.1 62.31 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.785 -0.572 . . . . 1.92 110.059 -178.469 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.5 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.701 -1.249 . . . . 1.05 109.196 179.665 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.5 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.5 t -73.68 -43.99 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.05 -1.031 . . . . 1.1 109.395 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.91 75.77 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.54 -0.725 . . . . 1.03 110.477 -178.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.8 p -60.77 -33.45 72.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.011 -1.056 . . . . 0.89 109.129 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -62.07 -39.87 93.87 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.406 -0.809 . . . . 2.06 109.438 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.76 1.34 55.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.313 -0.867 . . . . 1.05 111.162 -178.318 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 55.07 49.64 17.08 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.253 -0.905 . . . . 2.02 109.034 -179.291 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.78 130.7 28.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.41 -1.33 . . . . 1.05 107.41 -179.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -102.88 -12.12 17.76 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.624 -0.673 . . . . 2.16 109.998 -178.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.461 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.45 156.3 20.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.845 -1.159 . . . . 1.04 111.26 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -124.6 154.62 69.97 Favored Pre-proline 0 N--CA 1.499 2.01 0 N-CA-C 108.133 -1.062 . . . . 1.04 108.133 178.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -77.32 145.52 80.59 Favored 'Cis proline' 0 N--CA 1.492 1.406 0 C-N-CA 123.542 -1.441 . . . . 0.19 112.359 -3.115 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.41 131.1 48.47 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 108.564 -0.902 . . . . 1.04 108.564 178.125 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.547 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 89.8 m-85 -109.84 130.16 55.56 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.631 -0.668 . . . . 0.23 109.455 -179.207 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -120.63 140.45 51.54 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.41 -0.807 . . . . 0.43 109.04 179.104 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.9 131.97 53.95 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 121.117 0.484 . . . . 0.17 110.077 -179.341 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -124.84 145.83 49.58 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.492 0.663 . . . . 0.17 109.432 179.439 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.629 ' HZ1' ' N ' ' A' ' 22' ' ' LEU . 43.8 tptt -146.27 127.35 14.65 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.325 -1.361 . . . . 2.18 107.325 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.1 mttt 54.95 33.25 19.69 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.319 -0.863 . . . . 1.8 110.072 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.9 21.5 76.29 Favored Glycine 0 N--CA 1.491 2.312 0 O-C-N 120.913 -1.117 . . . . 0.23 110.921 178.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -131.02 141.51 50.23 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.209 -1.171 . . . . 2.75 109.786 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -77.67 126.84 31.49 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.98 -1.075 . . . . 2.3 109.51 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.0 m -122.25 12.1 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.766 -0.584 . . . . 1.06 110.187 -179.472 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.33 152.04 10.72 Favored Glycine 0 N--CA 1.493 2.447 0 C-N-CA 118.681 -1.723 . . . . 0.22 111.268 179.645 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.5 tp10 -163.04 137.49 6.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.819 -0.812 . . . . 1.93 109.451 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.483 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.2 p90 -163.37 158.82 21.68 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.591 -0.844 . . . . 0.16 109.976 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -125.97 161.66 27.0 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-O 121.326 0.584 . . . . 0.9 109.792 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.6 141.71 5.89 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.639 -1.384 . . . . 0.12 109.639 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.59 67.28 5.3 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.134 -1.216 . . . . 1.04 109.669 -179.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 99.01 6.36 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 108.684 -0.858 . . . . 1.36 108.684 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -35.03 75.26 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.157 -0.964 . . . . 1.6 111.479 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -64.13 -30.04 71.12 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.992 -1.067 . . . . 1.61 109.657 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.96 -37.4 82.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.693 -0.63 . . . . 2.02 109.612 -179.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.3 mt -58.77 -38.49 78.6 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.438 -0.949 . . . . 1.05 108.438 179.672 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.438 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 45.1 tp10 -63.99 -40.68 96.91 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 120.252 -0.579 . . . . 2.1 110.748 -178.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.09 -43.92 73.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.082 -1.011 . . . . 1.06 111.651 -178.567 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.29 -40.01 93.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.759 -1.213 . . . . 1.04 109.923 -178.777 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.36 -51.63 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.255 -0.903 . . . . 1.04 108.982 -179.733 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -60.33 -34.24 73.54 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.334 -0.988 . . . . 1.09 108.334 179.29 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -68.05 -39.91 82.91 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.611 -0.681 . . . . 2.21 110.426 -178.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.8 mt -99.58 -1.98 36.82 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.284 -0.885 . . . . 1.05 110.971 -178.666 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.667 -1.271 . . . . 1.08 109.3 -179.776 . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 108.963 -0.754 . . . . 1.89 108.963 . . . . . . . . . 0 0 . 1 . 025 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.6 mm -128.41 140.34 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.558 -0.534 . . . . 1.03 109.558 -179.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.5 m -100.58 124.63 46.42 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 107.102 -1.444 . . . . 0.19 107.102 178.002 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -75.51 140.04 42.55 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.94 -1.1 . . . . 0.93 111.468 -177.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 19.8 m95 -75.42 -10.23 59.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.21 108.807 178.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 . . . . . 0 N--CA 1.492 1.661 0 N-CA-C 108.582 -0.895 . . . . 0.49 108.582 179.319 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.0 tptp . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 108.521 -0.918 . . . . 2.18 108.521 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -98.6 124.14 43.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.493 -0.755 . . . . 0.4 109.429 179.784 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.439 HG22 HD11 ' A' ' 5' ' ' ILE . 31.2 mm -100.26 113.98 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 108.329 -0.989 . . . . 1.04 108.329 178.976 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -98.65 -0.52 42.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 2.25 109.689 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -155.25 157.89 37.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.057 -1.027 . . . . 0.91 110.948 179.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -65.16 -30.96 71.92 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.777 -1.194 . . . . 2.18 107.777 178.43 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.8 m -58.98 -47.36 85.44 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.327 -0.858 . . . . 1.03 108.941 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.1 -29.76 68.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.697 -0.853 . . . . 1.02 108.697 178.702 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -59.72 -44.78 93.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.227 -0.92 . . . . 0.15 109.259 -179.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -64.27 -43.65 94.19 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 121.809 0.814 . . . . 2.07 108.992 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.17 -37.36 87.12 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.341 0.591 . . . . 1.77 110.804 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.74 82.88 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.34 -0.85 . . . . 1.04 108.891 -179.373 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.3 mt -60.55 -40.2 90.71 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.352 -0.843 . . . . 1.07 108.791 179.638 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.26 -32.53 70.39 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.379 -0.825 . . . . 1.07 109.829 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.44 79.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.298 -0.876 . . . . 1.07 109.768 -179.078 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.83 76.36 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 1.03 109.317 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.89 -123.92 16.3 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.963 -1.255 . . . . 0.24 109.963 -179.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.42 2.3 54.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.971 -1.311 . . . . 1.07 110.589 -178.876 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -74.45 148.45 41.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.84 -1.162 . . . . 2.03 109.169 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.474 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -60.37 159.4 10.22 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.773 -1.566 . . . . 1.23 106.773 179.708 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.474 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 88.7 t -146.93 113.49 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 120.78 -1.2 . . . . 1.03 108.983 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -101.35 141.75 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 107.964 -1.125 . . . . 1.03 107.964 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.0 t -124.58 120.62 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.397 -0.814 . . . . 1.01 109.377 -179.226 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.7 t70 -99.47 118.66 36.56 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.418 -0.801 . . . . 1.05 110.447 179.595 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -95.06 24.15 5.1 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.513 -0.742 . . . . 0.73 109.735 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.4 m -59.0 145.12 43.01 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.993 -1.067 . . . . 0.84 109.671 -178.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.33 124.04 31.5 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.462 -1.31 . . . . 1.04 107.462 178.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -67.84 -31.79 71.87 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.102 -1.073 . . . . 1.08 108.102 179.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.53 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 53.0 p-90 -70.54 -23.04 62.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.745 -0.597 . . . . 0.29 110.584 179.629 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -83.95 116.46 22.81 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.333 -1.358 . . . . 0.26 107.333 179.54 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.54 -50.83 63.55 Favored Glycine 0 N--CA 1.49 2.294 0 C-N-CA 120.514 -0.851 . . . . 0.28 111.503 -177.692 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.8 Cg_exo -54.56 -35.02 84.9 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 CA-C-N 118.518 1.159 . . . . 0.5 112.052 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.69 -47.85 16.14 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.835 . . . . 1.04 109.642 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -60.12 -33.13 71.71 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.193 -1.04 . . . . 2.12 108.193 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.9 tpt -59.78 -30.17 68.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.837 -0.539 . . . . 2.66 109.725 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.5 mt -83.87 -2.04 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.705 -0.622 . . . . 1.22 110.88 -178.603 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.72 -30.81 7.56 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 120.423 -1.423 . . . . 1.44 113.028 -178.561 . . . . . . . . 3 3 . 1 . 026 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 24.4 Cg_exo -59.93 -42.17 47.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 CA-C-N 121.641 1.622 . . . . 0.31 112.826 -177.549 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -68.52 -45.98 70.79 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 118.628 -1.229 . . . . 0.45 108.767 -179.78 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -63.12 -51.97 64.4 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.977 -1.077 . . . . 0.16 109.572 179.002 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -67.46 -40.1 85.35 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.707 -0.62 . . . . 0.35 111.106 -179.444 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.8 m -63.88 -36.29 83.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.878 -1.139 . . . . 0.77 110.752 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.56 -20.82 65.95 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.212 -0.93 . . . . 1.07 110.656 -177.887 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.1 m -54.93 -36.46 65.29 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.917 -1.114 . . . . 0.87 108.632 -179.648 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.7 mp0 -88.18 -15.95 34.65 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.131 -0.98 . . . . 2.16 109.9 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -79.3 -37.42 37.76 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 107.169 -1.419 . . . . 2.29 107.169 179.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.466 ' C ' ' H ' ' A' ' 51' ' ' ASN . 77.6 m-85 -123.77 67.01 1.03 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 107.374 -1.343 . . . . 0.95 107.374 178.169 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.6 p -63.35 -5.72 3.86 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.14 -1.059 . . . . 0.89 108.14 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . 0.466 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.7 t-20 -79.99 -20.41 45.54 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.223 -0.658 . . . . 1.13 109.223 178.647 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 60.8 t -107.01 149.46 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 108.774 -0.824 . . . . 1.06 108.774 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.449 HG22 HD11 ' A' ' 53' ' ' ILE . 27.8 mm -99.79 120.0 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.258 -0.901 . . . . 1.04 108.678 -179.27 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -99.63 126.15 45.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.238 -0.914 . . . . 0.13 110.221 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.477 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.3 mp -111.49 141.59 44.86 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.225 -0.922 . . . . 1.08 109.35 178.78 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -109.23 132.1 54.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 106.853 -1.536 . . . . 1.13 106.853 178.338 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.0 t -127.89 131.09 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.448 -0.782 . . . . 1.03 109.858 -178.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.428 ' O ' ' N ' ' A' ' 62' ' ' ALA . 57.5 t0 -94.27 120.31 34.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.436 -0.79 . . . . 1.05 108.898 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.0 m -67.46 -19.52 25.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 120.627 -1.296 . . . . 1.04 108.329 179.203 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.53 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 17.6 m-20 -92.03 -45.04 8.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.509 -0.744 . . . . 1.08 111.726 -179.271 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -93.97 -13.59 26.87 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.566 -1.334 . . . . 1.07 108.195 179.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.428 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 36.98 4.51 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.734 -1.21 . . . . 1.03 107.734 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -60.03 -24.43 64.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.687 -0.633 . . . . 1.92 109.645 -178.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.538 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -66.67 -38.61 87.17 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.875 -1.141 . . . . 1.05 108.33 178.793 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.538 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.8 t -69.23 -44.54 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.395 -0.816 . . . . 1.1 109.626 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.56 -37.22 68.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.371 -0.831 . . . . 1.03 110.726 -178.664 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -60.24 -37.41 80.27 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.165 -0.959 . . . . 0.89 109.753 -178.785 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.07 -38.68 92.16 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.342 -0.849 . . . . 2.06 109.26 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.74 -1.46 56.28 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.47 -0.769 . . . . 1.05 111.014 -178.816 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 53.84 48.29 21.66 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.027 -1.046 . . . . 2.02 109.596 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.8 t -63.22 134.37 28.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 C-N-CA 118.787 -1.165 . . . . 1.05 108.142 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -106.92 -12.3 15.5 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.563 -0.71 . . . . 2.16 109.797 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.458 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.31 154.53 19.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 1.04 110.911 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -127.62 154.5 77.69 Favored Pre-proline 0 N--CA 1.496 1.864 0 N-CA-C 107.726 -1.212 . . . . 1.04 107.726 178.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.6 143.25 73.75 Favored 'Cis proline' 0 N--CA 1.489 1.248 0 C-N-CA 123.57 -1.429 . . . . 0.19 112.569 -2.183 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.5 m -128.37 133.84 48.72 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.869 -0.789 . . . . 1.04 108.869 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.519 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.1 m-85 -110.71 131.02 55.41 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.632 -0.877 . . . . 0.23 108.632 -179.413 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -122.47 140.19 53.02 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.533 -0.914 . . . . 0.43 108.533 179.429 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -106.63 132.94 52.05 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.377 0.608 . . . . 0.17 109.931 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -126.87 145.68 50.57 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 109.013 -0.736 . . . . 0.17 109.013 179.248 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -145.86 129.41 16.99 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 106.938 -1.505 . . . . 2.18 106.938 179.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.4 mttt 56.55 27.96 13.15 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.241 -0.912 . . . . 1.8 108.594 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.94 25.02 67.83 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.689 -1.364 . . . . 0.23 109.689 -179.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.412 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.4 mm100 -128.69 136.18 50.26 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.394 -1.062 . . . . 2.75 110.362 -179.82 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -79.38 128.15 32.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.236 -0.915 . . . . 2.3 109.654 179.461 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.4 m -123.93 3.98 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.76 -0.587 . . . . 1.06 110.377 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.22 155.89 17.1 Favored Glycine 0 N--CA 1.496 2.639 0 C-N-CA 118.648 -1.739 . . . . 0.22 111.506 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -164.04 148.7 10.21 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.865 -0.785 . . . . 1.93 109.482 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.436 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 6.3 p90 -164.37 157.33 17.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.613 -0.835 . . . . 0.16 109.913 178.218 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.2 p -125.8 160.41 29.89 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.391 0.615 . . . . 0.9 109.673 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.01 141.7 5.84 Favored Glycine 0 N--CA 1.487 2.052 0 N-CA-C 109.125 -1.59 . . . . 0.12 109.125 -179.91 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.01 65.76 2.1 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.378 -1.072 . . . . 1.04 109.57 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 96.98 5.39 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.217 -0.927 . . . . 1.36 108.567 179.062 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -31.95 70.25 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.12 -0.988 . . . . 1.6 111.722 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.28 -29.85 70.93 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.793 -1.192 . . . . 1.61 108.914 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.04 -35.73 77.68 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.705 -0.622 . . . . 2.02 109.403 -179.434 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 56.3 mt -59.88 -39.86 86.76 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.136 0.97 . . . . 1.05 108.508 179.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -61.99 -43.76 98.16 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.755 -0.657 . . . . 2.1 111.087 -177.677 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.93 -44.1 73.74 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.035 -1.041 . . . . 1.06 111.659 -178.323 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -66.13 -40.2 90.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.87 -1.144 . . . . 1.04 110.165 -178.444 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.36 -50.11 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.036 -1.04 . . . . 1.04 108.548 179.351 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -59.94 -36.39 76.95 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.905 0.86 . . . . 1.09 108.846 179.209 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -67.72 -39.9 84.28 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.812 -0.555 . . . . 2.21 109.846 -178.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.8 mt -97.56 -4.53 37.58 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.152 -0.968 . . . . 1.05 111.267 -179.201 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 120.411 -1.431 . . . . 1.08 109.285 -179.48 . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.129 -0.693 . . . . 1.89 109.129 . . . . . . . . . 0 0 . 1 . 026 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.1 mm -130.04 140.27 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 122.045 -0.409 . . . . 1.03 110.232 -179.339 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 27.8 m -98.9 130.54 45.3 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 177.497 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.1 m -81.25 144.79 31.31 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.721 -1.237 . . . . 0.93 110.875 -178.189 . . . . . . . . 1 1 . 1 . 026 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.433 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.0 m95 -79.72 -15.49 57.42 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.236 -0.915 . . . . 0.21 109.53 178.727 . . . . . . . . 2 2 . 1 . 026 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 C--N 1.303 -1.442 0 N-CA-C 107.465 -1.309 . . . . 0.49 107.465 179.126 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.1 tttp . . . . . 0 N--CA 1.496 1.854 0 N-CA-C 109.037 -0.727 . . . . 2.18 109.037 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -96.56 125.45 41.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.403 -0.811 . . . . 0.4 109.075 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.414 HG22 HD11 ' A' ' 5' ' ' ILE . 45.3 mm -100.32 111.26 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 N-CA-C 108.517 -0.92 . . . . 1.04 108.517 179.348 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.498 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 54.1 mp0 -98.88 -1.16 40.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.176 -0.952 . . . . 2.25 108.613 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -155.17 156.91 36.55 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.366 -0.834 . . . . 0.91 110.378 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -62.92 -33.37 75.2 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.195 -1.039 . . . . 2.18 108.195 178.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.0 m -53.59 -49.51 67.63 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.524 -0.87 . . . . 1.03 109.213 -178.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -30.48 69.37 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.334 -0.854 . . . . 1.02 109.165 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -58.49 -45.28 89.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.897 -1.127 . . . . 0.15 108.927 -179.478 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -64.88 -41.78 95.36 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.484 -0.76 . . . . 2.07 109.134 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.73 -39.72 94.12 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 1.77 110.819 -179.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.59 82.08 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.044 -1.035 . . . . 1.04 109.016 -179.31 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.22 -41.71 93.65 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.938 -1.134 . . . . 1.07 107.938 179.165 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.49 -37.02 77.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.572 -0.705 . . . . 1.07 110.273 179.813 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.24 -39.64 82.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 1.07 110.429 -179.203 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.23 -27.91 69.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.91 . . . . 1.03 108.952 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.04 -126.36 28.78 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.625 -1.39 . . . . 0.24 109.625 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -90.69 4.52 51.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.118 -1.225 . . . . 1.07 110.059 -179.192 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -74.75 150.52 39.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.873 -1.142 . . . . 2.03 109.079 -179.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.504 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -59.62 159.5 8.41 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.511 -1.292 . . . . 1.23 107.511 -179.253 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.504 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 61.8 t -147.25 116.89 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 120.993 -1.067 . . . . 1.03 108.3 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.31 144.01 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.211 -1.033 . . . . 1.03 108.211 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.4 t -125.24 123.78 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.38 -0.825 . . . . 1.01 109.938 -179.322 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -100.98 120.16 39.77 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.28 -0.888 . . . . 1.05 110.075 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -95.87 22.41 7.41 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.925 -1.109 . . . . 0.73 110.107 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -58.12 149.0 24.81 Favored 'General case' 0 C--N 1.296 -1.745 0 O-C-N 120.969 -1.082 . . . . 0.84 110.494 -178.057 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.59 124.18 31.85 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.963 -1.125 . . . . 1.04 107.963 179.389 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -65.18 -32.07 73.57 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 118.78 -1.168 . . . . 1.08 108.21 -179.795 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.524 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 51.9 p-90 -72.38 -24.37 61.25 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.326 -0.859 . . . . 0.29 111.495 179.672 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -82.8 116.65 22.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.584 -1.322 . . . . 0.26 109.304 -178.741 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.442 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.12 -51.98 54.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 111.267 -0.733 . . . . 0.28 111.267 -178.753 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.6 Cg_exo -50.98 -34.97 48.5 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 CA-C-N 118.776 1.288 . . . . 0.5 111.673 179.518 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.8 -47.45 15.17 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.39 -0.818 . . . . 1.04 109.637 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.74 -33.14 71.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.06 -1.025 . . . . 2.12 108.863 179.141 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 23.5 ttt -58.34 -26.21 62.84 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.516 -0.74 . . . . 2.66 109.969 179.366 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.7 mt -86.27 -2.36 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.406 -0.809 . . . . 1.22 111.14 -178.705 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.553 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -63.38 -30.56 5.51 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 120.187 -1.571 . . . . 1.44 113.298 -177.533 . . . . . . . . 3 3 . 1 . 027 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 29.3 Cg_exo -60.15 -41.27 53.03 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 CA-C-N 121.492 1.569 . . . . 0.31 112.375 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -68.63 -48.52 63.86 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.797 -1.189 . . . . 0.45 109.534 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -60.91 -51.94 67.14 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.154 -0.967 . . . . 0.16 109.151 179.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -65.72 -43.31 89.48 Favored 'General case' 0 C--N 1.292 -1.892 0 O-C-N 121.691 -0.63 . . . . 0.35 110.747 179.634 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.484 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.5 m -62.77 -39.49 94.35 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.829 -1.169 . . . . 0.77 111.392 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.7 -20.06 63.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.97 -1.082 . . . . 1.07 110.159 -178.201 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.5 m -53.98 -39.71 66.26 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.974 -1.09 . . . . 0.87 108.284 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -83.07 -18.16 40.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.044 -1.035 . . . . 2.16 109.867 178.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -76.85 -35.69 57.34 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.244 -1.391 . . . . 2.29 107.244 179.597 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -123.8 67.11 1.03 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.405 -1.332 . . . . 0.95 107.405 178.183 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.3 p -64.28 -10.42 23.78 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 108.868 -0.79 . . . . 0.89 108.868 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -90.23 8.45 33.09 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.04 -1.096 . . . . 1.13 108.04 179.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.16 143.65 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 107.483 -1.303 . . . . 1.06 107.483 178.598 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.428 HG22 HD11 ' A' ' 53' ' ' ILE . 27.7 mm -98.99 121.22 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.222 -0.924 . . . . 1.04 109.614 -178.375 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -99.15 127.88 45.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.13 109.403 179.392 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.408 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 2.8 mp -111.7 146.36 37.65 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.349 -0.845 . . . . 1.08 109.333 178.903 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -116.04 129.83 56.54 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.775 -1.565 . . . . 1.13 106.775 177.778 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.8 t -126.79 132.78 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 CA-C-O 121.547 0.689 . . . . 1.03 109.827 -178.359 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -97.98 118.92 35.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.535 -0.913 . . . . 1.05 108.535 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.2 m -65.57 -20.87 28.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 120.252 -1.53 . . . . 1.04 108.247 179.292 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.524 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 3.4 m-20 -92.14 -41.51 10.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.517 -0.739 . . . . 1.08 112.406 -177.982 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -95.49 -20.98 18.61 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.402 -1.436 . . . . 1.07 108.437 179.223 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.98 43.42 2.79 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 108.238 -1.023 . . . . 1.03 108.238 179.258 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -61.56 -19.3 62.01 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.615 -0.678 . . . . 1.92 109.645 -179.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.431 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.5 p30 -62.8 -40.47 97.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.105 -0.997 . . . . 1.05 109.583 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.431 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 22.2 t -72.31 -43.45 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.244 -0.91 . . . . 1.1 109.69 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.49 -39.16 74.33 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.647 -0.658 . . . . 1.03 111.371 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -61.21 -36.0 78.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.983 -1.073 . . . . 0.89 109.191 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -64.97 -39.67 93.84 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.527 -0.733 . . . . 2.06 109.24 179.508 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.15 -3.2 58.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 1.05 110.791 -178.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 55.51 50.31 14.88 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.002 -1.062 . . . . 2.02 109.746 -179.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.62 134.03 28.91 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 C-N-CA 118.627 -1.229 . . . . 1.05 108.63 -179.049 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -105.0 -12.72 16.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.67 -0.644 . . . . 2.16 110.23 -179.197 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.43 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 155.55 20.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.908 -1.12 . . . . 1.04 110.92 179.526 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.1 p -128.91 154.45 80.2 Favored Pre-proline 0 N--CA 1.499 1.983 0 N-CA-C 107.455 -1.313 . . . . 1.04 107.455 178.582 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -76.91 143.17 74.92 Favored 'Cis proline' 0 N--CA 1.492 1.43 0 C-N-CA 123.985 -1.256 . . . . 0.19 112.854 -1.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.0 m -130.0 134.75 47.63 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.044 -0.724 . . . . 1.04 109.044 178.55 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -110.58 130.16 55.63 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.378 0.608 . . . . 0.23 109.777 -179.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -120.98 139.94 52.58 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 108.189 -1.041 . . . . 0.43 108.189 179.29 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -105.84 134.97 48.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.669 -0.644 . . . . 0.17 110.126 -178.94 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -129.45 145.85 51.37 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.709 0.766 . . . . 0.17 109.577 179.266 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -149.09 131.18 15.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.372 -1.714 . . . . 2.18 106.372 179.072 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.6 mttt 57.33 30.08 17.92 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.186 -0.946 . . . . 1.8 109.575 -178.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.56 18.31 79.84 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.451 -1.06 . . . . 0.23 110.451 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -127.52 142.88 51.27 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.388 -1.066 . . . . 2.75 109.654 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -80.06 131.55 35.79 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.432 -0.792 . . . . 2.3 109.324 179.572 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.1 m -121.8 11.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.814 -0.554 . . . . 1.06 110.374 -179.638 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 167.49 161.54 17.18 Favored Glycine 0 N--CA 1.498 2.805 0 C-N-CA 118.42 -1.848 . . . . 0.22 112.012 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -165.32 149.23 8.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.872 -0.781 . . . . 1.93 110.198 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 12.1 p90 -162.84 160.59 25.3 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.078 -1.014 . . . . 0.16 109.135 177.876 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.29 164.9 20.0 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 121.492 0.663 . . . . 0.9 109.932 -178.914 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.74 142.38 6.68 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.072 -1.611 . . . . 0.12 109.072 179.862 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.78 62.96 3.41 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.272 -1.134 . . . . 1.04 109.495 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.72 97.37 5.94 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.475 -0.766 . . . . 1.36 109.015 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -32.66 72.4 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.332 -0.855 . . . . 1.6 111.265 -179.704 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.87 -30.04 71.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.044 -1.035 . . . . 1.61 109.934 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -61.23 -35.95 78.64 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.626 0.727 . . . . 2.02 109.206 -179.1 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.9 mt -59.52 -39.43 83.84 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 122.253 1.025 . . . . 1.05 108.968 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -62.43 -43.07 99.69 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 119.824 -0.75 . . . . 2.1 110.745 -177.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.15 69.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.951 -1.093 . . . . 1.06 111.031 -178.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.3 m -63.97 -40.16 95.77 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 1.04 109.874 -178.714 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.7 mt -61.29 -50.02 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 N-CA-C 107.849 -1.167 . . . . 1.04 107.849 178.784 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -60.26 -35.08 74.68 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.693 -0.855 . . . . 1.09 108.693 178.945 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -67.65 -38.57 84.0 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.418 -0.801 . . . . 2.21 109.881 -178.639 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.0 mt -99.21 -4.16 32.68 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.065 -1.022 . . . . 1.05 111.405 -179.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.496 1.868 0 O-C-N 120.538 -1.351 . . . . 1.08 109.164 -179.177 . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.536 -0.542 . . . . 1.89 109.536 . . . . . . . . . 0 0 . 1 . 027 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 35.3 mm -130.28 139.88 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.856 -0.528 . . . . 1.03 110.404 -179.541 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.6 m -98.17 125.38 43.17 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 107.524 -1.287 . . . . 0.19 107.524 177.334 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -77.93 145.07 36.34 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.831 -1.168 . . . . 0.93 111.689 -178.348 . . . . . . . . 1 1 . 1 . 027 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.43 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.6 m95 -76.7 -12.02 59.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.805 . . . . 0.21 108.976 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.031 -1.043 . . . . 0.49 108.485 179.654 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 N--CA 1.5 2.028 0 N-CA-C 108.889 -0.782 . . . . 2.18 108.889 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -95.96 124.22 39.88 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.888 -1.132 . . . . 0.4 108.595 178.74 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.404 HG22 HD11 ' A' ' 5' ' ' ILE . 31.4 mm -102.0 112.03 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.341 -0.849 . . . . 1.04 109.329 179.57 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.48 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.1 mp0 -97.21 -1.0 45.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.946 . . . . 2.25 109.372 179.836 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -154.87 157.62 38.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.59 -1.319 . . . . 0.91 111.208 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.492 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 34.4 ttmt -63.88 -32.48 74.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.017 -1.105 . . . . 2.18 108.017 177.648 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.4 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 52.1 m -56.28 -46.43 79.74 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.319 -0.952 . . . . 1.03 108.841 -178.82 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.59 -30.25 66.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.256 -0.902 . . . . 1.02 109.166 178.745 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -59.86 -43.81 94.47 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.397 -0.815 . . . . 0.15 108.974 -179.025 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -65.55 -42.96 91.31 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.693 0.759 . . . . 2.07 109.819 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -66.52 -39.7 88.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.556 -0.715 . . . . 1.77 110.06 179.638 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.9 96.26 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.304 -0.872 . . . . 1.04 108.696 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.4 mt -59.92 -40.25 88.23 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.219 -0.926 . . . . 1.07 108.597 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -69.39 -36.33 76.68 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.181 -0.95 . . . . 1.07 110.009 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.6 -39.31 84.8 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.343 -0.848 . . . . 1.07 110.516 -178.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -32.45 70.96 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.228 -0.92 . . . . 1.03 108.966 -179.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.55 -124.02 17.59 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.968 -1.253 . . . . 0.24 109.968 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -93.43 5.31 52.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.32 -1.106 . . . . 1.07 110.505 -179.073 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -76.55 149.28 36.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.157 -0.964 . . . . 2.03 109.173 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.474 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.31 157.73 13.05 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 106.861 -1.533 . . . . 1.23 106.861 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.474 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 99.5 t -143.95 112.39 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.049 -1.032 . . . . 1.03 108.685 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -100.17 144.68 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 108.443 -0.947 . . . . 1.03 108.443 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.4 t -126.4 121.09 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 O-C-N 121.273 -0.892 . . . . 1.01 109.796 -179.917 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.0 t70 -98.66 120.08 38.49 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.217 -0.927 . . . . 1.05 109.872 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -96.3 23.27 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.342 -0.849 . . . . 0.73 110.059 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.3 m -58.67 147.36 33.06 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.054 -1.029 . . . . 0.84 110.746 -178.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.76 125.57 32.68 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 107.94 -1.133 . . . . 1.04 107.94 178.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -67.98 -33.91 75.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 118.957 -1.097 . . . . 1.08 108.573 -179.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.452 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 57.0 p-90 -70.42 -23.93 62.83 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.322 -0.861 . . . . 0.29 110.387 179.396 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.46 119.83 24.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.599 -1.313 . . . . 0.26 107.486 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -64.7 -51.29 53.09 Favored Glycine 0 N--CA 1.49 2.243 0 C-N-CA 120.3 -0.952 . . . . 0.28 110.737 -178.152 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -51.8 -36.34 62.23 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 118.553 1.176 . . . . 0.5 112.504 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.46 -48.86 16.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.97 . . . . 1.04 109.883 179.918 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.6 -34.91 74.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.119 -0.988 . . . . 2.12 109.465 179.309 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -60.01 -28.95 68.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.568 -0.708 . . . . 2.66 109.955 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 68.2 mt -83.31 -0.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.753 -0.592 . . . . 1.22 110.379 -178.939 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.66 -30.26 6.22 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 120.674 -1.266 . . . . 1.44 113.051 -179.047 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.9 Cg_exo -59.76 -42.9 41.95 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 CA-C-N 121.699 1.643 . . . . 0.31 113.333 -177.507 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -67.91 -47.87 67.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.432 -1.417 . . . . 0.45 108.561 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -59.84 -51.53 69.32 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.296 -0.878 . . . . 0.16 110.104 179.174 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -69.37 -44.42 71.57 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 121.801 -0.562 . . . . 0.35 111.092 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 61.1 m -61.39 -39.96 92.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.147 -0.971 . . . . 0.77 110.332 -179.263 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -59.59 -24.28 63.64 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.12 -0.987 . . . . 1.07 110.113 -178.801 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -51.83 -36.53 48.36 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 120.648 -1.283 . . . . 0.87 108.957 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.7 mp0 -86.14 -14.34 44.41 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.116 -0.99 . . . . 2.16 109.43 179.178 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -80.38 -34.24 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.064 -1.458 . . . . 2.29 107.064 178.049 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -124.79 64.25 1.12 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.372 -1.344 . . . . 0.95 107.372 177.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -61.52 -9.7 6.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.542 -0.724 . . . . 0.89 109.27 -179.271 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -91.6 9.83 30.58 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.336 -0.987 . . . . 1.13 108.336 179.216 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 47.8 t -127.39 142.11 44.49 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 N-CA-C 106.683 -1.599 . . . . 1.06 106.683 178.575 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 53' ' ' ILE . 26.2 mm -99.79 119.61 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.053 -1.029 . . . . 1.04 109.425 -178.424 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -99.07 124.43 44.07 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.309 -0.87 . . . . 0.13 110.293 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.463 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.7 mp -109.16 141.43 41.38 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.168 -0.958 . . . . 1.08 109.095 178.855 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -110.02 132.35 54.24 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 106.925 -1.509 . . . . 1.13 106.925 178.101 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.9 t -128.38 132.54 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.476 -0.765 . . . . 1.03 110.416 -177.894 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -95.81 119.6 34.58 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.458 -0.776 . . . . 1.05 109.044 179.55 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.59 -16.57 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.469 -1.394 . . . . 1.04 108.598 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.6 m-20 -92.11 -42.91 9.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.449 -0.782 . . . . 1.08 111.506 -178.656 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -97.32 -23.4 16.14 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.869 -1.144 . . . . 1.07 108.638 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -114.08 36.36 3.74 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.828 -1.545 . . . . 1.03 106.828 179.191 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.3 OUTLIER -59.67 -20.53 56.85 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.657 -0.702 . . . . 1.92 110.037 -178.736 . . . . . . . . 3 3 . 1 . 028 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -67.13 -37.43 83.84 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.98 -1.075 . . . . 1.05 109.201 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.524 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 19.0 t -72.89 -43.54 59.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.212 -0.93 . . . . 1.1 109.279 179.91 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.77 -40.04 72.87 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.71 -0.619 . . . . 1.03 110.849 -178.464 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.2 p -60.98 -35.41 76.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.514 -1.366 . . . . 0.89 108.864 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.492 ' OE2' ' NZ ' ' A' ' 8' ' ' LYS . 36.9 tt0 -62.22 -39.59 93.29 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.448 -0.782 . . . . 2.06 109.401 178.796 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.74 -2.56 58.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.28 -0.887 . . . . 1.05 110.767 -179.299 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 55.57 49.16 17.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.214 -0.929 . . . . 2.02 109.133 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.1 t -62.74 131.83 28.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 C-N-CA 118.267 -1.373 . . . . 1.05 108.397 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -102.85 -12.42 17.57 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.668 -0.645 . . . . 2.16 109.828 -178.983 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.22 155.93 18.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.704 -1.247 . . . . 1.04 110.588 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -128.47 153.77 79.28 Favored Pre-proline 0 N--CA 1.5 2.071 0 N-CA-C 107.796 -1.187 . . . . 1.04 107.796 178.642 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -76.51 141.07 68.82 Favored 'Cis proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.797 -1.335 . . . . 0.19 113.331 -2.115 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.2 m -125.72 135.16 51.77 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 108.246 -1.02 . . . . 1.04 108.246 177.918 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.519 ' CE2' ' OD1' ' A' ' 26' ' ' ASP . 89.7 m-85 -111.21 132.48 54.29 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.801 -0.815 . . . . 0.23 108.801 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -123.35 141.86 51.55 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.134 -0.979 . . . . 0.43 108.696 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -109.02 131.45 55.06 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.588 0.709 . . . . 0.17 111.19 -178.504 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -126.57 145.66 50.45 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.395 0.617 . . . . 0.17 109.511 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -147.98 130.39 15.73 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.368 -1.345 . . . . 2.18 107.368 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.3 mttt 57.45 29.45 17.02 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.223 -0.923 . . . . 1.8 108.841 -178.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.66 18.23 79.17 Favored Glycine 0 N--CA 1.49 2.248 0 C-N-CA 120.026 -1.083 . . . . 0.23 110.557 179.811 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -126.82 140.75 52.13 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.185 -1.185 . . . . 2.75 110.467 179.907 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -79.64 129.73 34.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.412 -0.805 . . . . 2.3 108.869 179.198 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.5 m -125.43 3.91 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.588 -0.695 . . . . 1.06 110.187 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.89 156.97 20.05 Favored Glycine 0 N--CA 1.496 2.634 0 C-N-CA 118.108 -1.996 . . . . 0.22 111.984 -179.477 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -165.99 149.62 7.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.977 -0.719 . . . . 1.93 109.719 179.11 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.432 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 17.6 p90 -164.1 160.85 22.01 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.186 -1.005 . . . . 0.16 109.404 177.447 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -126.02 160.75 29.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.647 -0.658 . . . . 0.9 109.901 -179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.91 138.89 5.61 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 108.931 -1.668 . . . . 0.12 108.931 179.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.71 65.5 3.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.214 -1.168 . . . . 1.04 110.711 -178.889 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.2 t-20 -118.03 101.66 8.43 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.273 -1.01 . . . . 1.36 108.273 178.109 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -33.2 72.66 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.332 -0.855 . . . . 1.6 111.3 -179.398 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.8 -29.92 71.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.868 -1.145 . . . . 1.61 109.575 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.436 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 79.2 tttt -62.79 -33.99 76.35 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.637 -0.665 . . . . 2.02 109.392 -179.097 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.86 -39.91 86.83 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.53 -0.915 . . . . 1.05 108.53 179.733 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.05 -42.44 99.72 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.428 -0.909 . . . . 2.1 110.523 -178.451 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.38 77.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.949 -1.094 . . . . 1.06 111.123 -178.412 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.5 m -65.98 -39.93 90.76 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.61 -1.306 . . . . 1.04 108.599 -179.822 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.01 -47.0 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.396 -1.335 . . . . 1.04 107.396 177.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.74 -36.77 79.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.504 -0.924 . . . . 1.09 108.504 179.047 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.27 -39.72 82.07 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.759 -0.588 . . . . 2.21 109.878 -179.174 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.1 mt -98.33 -2.75 38.65 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.429 -0.794 . . . . 1.05 111.661 -178.632 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.499 1.978 0 O-C-N 120.535 -1.353 . . . . 1.08 109.391 -179.119 . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 109.688 -0.486 . . . . 1.89 109.688 . . . . . . . . . 0 0 . 1 . 028 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 33.4 mm -129.88 140.19 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 121.583 -0.698 . . . . 1.03 109.463 -179.776 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 26.8 m -96.38 127.08 42.05 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 106.896 -1.52 . . . . 0.19 106.896 177.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.7 m -76.89 141.14 40.68 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.958 -1.089 . . . . 0.93 111.123 -178.042 . . . . . . . . 1 1 . 1 . 028 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.423 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.7 m95 -77.18 -11.87 59.87 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.009 -1.057 . . . . 0.21 109.32 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . 0.405 ' N ' HD21 ' B' ' 68' ' ' ASN . 2.2 m120 . . . . . 0 C--N 1.301 -1.504 0 N-CA-C 108.636 -0.876 . . . . 0.49 108.636 179.583 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 tppt? . . . . . 0 N--CA 1.495 1.818 0 N-CA-C 108.414 -0.958 . . . . 2.18 108.414 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -98.95 123.07 42.98 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.659 -0.867 . . . . 0.4 108.659 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.6 mm -100.81 114.16 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.761 -0.829 . . . . 1.04 108.761 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.496 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.0 mp0 -97.22 -0.12 47.29 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.241 -0.912 . . . . 2.25 109.751 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.22 156.28 38.21 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.812 -1.18 . . . . 0.91 111.271 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -64.67 -30.92 71.95 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.13 -1.063 . . . . 2.18 108.13 178.323 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -58.21 -49.43 77.09 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.612 -0.835 . . . . 1.03 108.863 -179.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -29.48 67.65 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.43 -0.794 . . . . 1.02 109.079 178.994 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -59.71 -44.15 93.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.202 -0.936 . . . . 0.15 109.136 -179.834 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -66.93 -42.94 84.47 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.778 -0.769 . . . . 2.07 108.932 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -64.13 -36.55 84.42 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.519 -0.738 . . . . 1.77 110.352 179.569 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.03 -42.83 79.99 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.375 -0.828 . . . . 1.04 109.061 -179.36 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.3 mt -60.86 -39.99 91.22 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -0.876 . . . . 1.07 108.662 179.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -69.7 -36.4 75.91 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.425 -0.797 . . . . 1.07 109.632 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.16 -36.82 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.435 -0.791 . . . . 1.07 110.269 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.03 -27.53 69.47 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.139 -0.975 . . . . 1.03 109.534 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.29 -129.47 28.74 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.861 -1.295 . . . . 0.24 109.861 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -93.09 7.53 43.8 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.284 -1.127 . . . . 1.07 110.473 -179.112 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -75.6 149.92 38.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.018 -1.051 . . . . 2.03 109.453 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.418 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.08 153.92 20.57 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 107.216 -1.402 . . . . 1.23 107.216 179.73 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.418 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 63.8 t -143.29 117.38 3.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 121.002 -1.061 . . . . 1.03 108.531 179.954 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.36 139.27 25.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 108.055 -1.091 . . . . 1.03 108.055 179.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.5 t -121.68 123.16 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.401 -0.812 . . . . 1.01 108.941 -179.783 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.545 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.9 t70 -102.75 110.01 21.79 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.649 -0.657 . . . . 1.05 110.924 -179.521 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -90.1 103.79 16.43 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.748 -1.575 . . . . 0.73 106.748 176.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.433 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 63.8 m -130.02 146.97 51.72 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.705 -0.85 . . . . 0.84 108.705 179.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.48 121.6 28.41 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.571 -1.27 . . . . 1.04 107.571 179.259 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -65.69 -32.36 73.88 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 118.514 -1.274 . . . . 1.08 107.618 179.801 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.434 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 60.4 p-90 -70.27 -25.75 63.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.513 -0.742 . . . . 0.29 110.809 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.12 116.85 22.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.812 -1.18 . . . . 0.26 108.458 -179.318 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.453 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.67 -52.0 55.18 Favored Glycine 0 N--CA 1.49 2.262 0 C-N-CA 120.724 -0.75 . . . . 0.28 111.45 -178.425 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -53.23 -33.19 63.87 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 CA-C-N 118.497 1.148 . . . . 0.5 112.183 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.08 -52.76 8.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.208 -0.932 . . . . 1.04 109.865 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -60.13 -36.73 78.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.03 -1.044 . . . . 2.12 109.611 179.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 36.7 tpp -59.65 -28.1 66.94 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.457 -0.777 . . . . 2.66 109.914 -179.49 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.415 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 76.9 mt -80.22 -4.01 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 1.22 110.781 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.02 -29.94 6.14 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.371 -1.456 . . . . 1.44 114.47 -177.711 . . . . . . . . 3 3 . 1 . 029 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 39.5 Cg_exo -59.22 -40.55 68.04 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 CA-C-N 122.039 1.764 . . . . 0.31 113.506 -177.452 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -68.1 -47.22 68.8 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 118.295 -1.362 . . . . 0.45 108.74 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.64 -50.77 69.91 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.391 -0.818 . . . . 0.16 109.73 179.126 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -66.77 -41.33 87.9 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.602 -0.686 . . . . 0.35 110.441 -179.517 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.2 m -63.03 -37.73 88.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.236 -0.915 . . . . 0.77 110.652 -179.859 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.07 -25.72 67.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.174 -0.953 . . . . 1.07 110.285 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.6 m -51.44 -39.45 57.4 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.981 -1.075 . . . . 0.87 108.577 -179.359 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -84.48 -16.72 41.49 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.469 -0.769 . . . . 2.16 109.366 179.955 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.604 ' HZ3' ' HH ' ' A' ' 49' ' ' TYR . 61.1 tttm -78.89 -36.62 41.82 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.776 -1.202 . . . . 2.29 108.179 179.659 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.604 ' HH ' ' HZ3' ' A' ' 48' ' ' LYS . 84.2 m-85 -123.96 66.17 1.04 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.008 -1.479 . . . . 0.95 107.008 177.728 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.5 p -61.78 -9.71 7.19 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.279 -0.637 . . . . 0.89 109.279 -179.105 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -89.93 9.1 29.04 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.271 -1.011 . . . . 1.13 108.271 179.044 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.8 t -127.37 144.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 107.688 -1.227 . . . . 1.06 107.688 178.739 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.3 mm -99.92 122.76 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 120.99 -1.068 . . . . 1.04 109.594 -178.152 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -104.21 124.87 49.89 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.175 -0.953 . . . . 0.13 110.203 -179.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.476 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.6 mp -111.31 140.34 45.96 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.071 -1.018 . . . . 1.08 109.903 178.804 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -110.48 132.01 54.55 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.019 -1.474 . . . . 1.13 107.019 177.84 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 64.7 t -125.63 136.08 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.464 -0.772 . . . . 1.03 110.847 -177.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -97.04 118.85 34.38 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.396 -0.965 . . . . 1.05 108.396 179.332 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.6 m -68.03 -19.21 24.5 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 O-C-N 120.568 -1.333 . . . . 1.04 108.723 179.56 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.434 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 4.7 m-20 -93.68 -42.36 9.21 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.432 -0.793 . . . . 1.08 111.736 -179.232 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -94.13 -15.77 24.38 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.574 -1.329 . . . . 1.07 108.489 179.636 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.83 38.42 4.2 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.505 -1.295 . . . . 1.03 107.505 179.228 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -59.95 -20.21 56.26 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.376 -0.602 . . . . 1.92 109.376 -178.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.541 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -63.94 -39.12 93.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.153 -0.967 . . . . 1.05 109.156 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.541 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 21.8 t -73.39 -43.22 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.196 -0.94 . . . . 1.1 108.992 179.634 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.57 -40.05 80.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.528 -0.733 . . . . 1.03 110.935 -178.658 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.5 p -60.07 -37.6 80.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.797 -1.189 . . . . 0.89 108.556 -179.75 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.93 -36.1 82.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.502 -0.749 . . . . 2.06 109.143 178.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.94 -2.18 58.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.293 -0.879 . . . . 1.05 111.217 -178.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 52.72 49.95 19.19 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.775 -1.203 . . . . 2.02 109.776 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.3 t -64.94 131.99 30.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 C-N-CA 118.826 -1.15 . . . . 1.05 108.534 -179.413 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -104.29 -12.78 16.43 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.694 -0.629 . . . . 2.16 109.73 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.63 155.8 17.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.996 -1.065 . . . . 1.04 110.526 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.0 154.25 81.18 Favored Pre-proline 0 N--CA 1.501 2.112 0 N-CA-C 108.065 -1.087 . . . . 1.04 108.065 178.582 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -76.0 143.92 78.16 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.987 -1.255 . . . . 0.19 112.852 -2.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.6 m -128.68 135.9 49.9 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 108.493 -0.929 . . . . 1.04 108.493 178.828 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.545 ' CE2' ' OD1' ' A' ' 26' ' ' ASP . 87.5 m-85 -108.25 129.7 55.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.23 109.187 -179.075 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.3 136.17 54.86 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.164 -1.05 . . . . 0.43 108.164 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -104.57 134.83 47.09 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.417 0.627 . . . . 0.17 110.363 -179.025 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.93 148.95 48.1 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.621 0.724 . . . . 0.17 109.3 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -146.54 122.97 11.02 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.049 -1.463 . . . . 2.18 107.049 179.679 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 74.4 mttt 58.05 27.27 14.63 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.904 -1.147 . . . . 1.8 107.904 -178.403 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.418 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 80.49 11.04 84.58 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.515 -1.034 . . . . 0.23 110.515 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.418 HE21 ' C ' ' A' ' 83' ' ' GLY . 6.4 mm-40 -112.63 134.52 54.11 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.413 -1.051 . . . . 2.75 109.919 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -79.31 123.91 27.9 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.996 -1.113 . . . . 2.3 107.996 178.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.4 m -124.79 12.12 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.809 -0.557 . . . . 1.06 110.452 -179.197 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.41 152.44 11.07 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 118.685 -1.721 . . . . 0.22 111.496 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -167.26 148.89 5.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.723 -0.869 . . . . 1.93 109.87 179.254 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.685 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 21.9 p90 -164.02 162.59 23.25 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 119.652 -0.819 . . . . 0.16 109.127 177.209 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -125.38 160.51 29.2 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 121.609 0.719 . . . . 0.9 110.329 -179.014 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.61 140.06 6.27 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.47 -1.452 . . . . 0.12 109.47 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.29 66.95 3.99 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.372 -1.075 . . . . 1.04 111.042 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.98 96.88 5.66 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 106.919 -1.512 . . . . 1.36 106.919 177.861 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -37.49 77.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.565 -0.709 . . . . 1.6 112.705 -177.783 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -63.08 -28.86 70.37 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.888 -1.133 . . . . 1.61 109.572 -179.768 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.685 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 21.0 ttpp -63.93 -33.76 76.44 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.584 -0.698 . . . . 2.02 109.682 -179.032 . . . . . . . . 2 2 . 1 . 029 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 34.2 mt -57.96 -38.91 76.89 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.985 -1.117 . . . . 1.05 107.985 179.036 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -60.47 -42.13 95.61 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 115.629 -0.714 . . . . 2.1 110.014 -178.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.08 77.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.182 -0.948 . . . . 1.06 110.958 -179.239 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.34 -39.89 89.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.924 -1.11 . . . . 1.04 109.309 -179.158 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.5 mt -60.91 -49.65 83.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 107.758 -1.201 . . . . 1.04 107.758 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -60.06 -35.42 75.1 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.806 0.813 . . . . 1.09 109.024 178.934 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -67.57 -40.0 84.88 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.523 -0.735 . . . . 2.21 109.986 -178.407 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.3 mt -100.16 1.08 41.71 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.224 -0.923 . . . . 1.05 111.605 -178.756 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.468 -1.395 . . . . 1.08 109.87 -179.237 . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp . . . . . 0 N--CA 1.493 1.719 0 N-CA-C 109.609 -0.515 . . . . 1.89 109.609 . . . . . . . . . 0 0 . 1 . 029 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 24.2 mm -129.96 140.49 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 O-C-N 121.765 -0.584 . . . . 1.03 110.065 -179.059 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.9 m -93.24 128.1 39.09 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.309 -1.367 . . . . 0.19 107.309 177.431 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -80.28 137.13 36.56 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.043 -1.036 . . . . 0.93 111.211 -178.287 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -73.59 -10.31 59.58 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.091 -1.006 . . . . 0.21 109.309 179.001 . . . . . . . . 1 1 . 1 . 029 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . 0.417 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.9 m120 . . . . . 0 C--N 1.299 -1.6 0 O-C-N 121.596 -0.69 . . . . 0.49 109.355 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.9 tptp . . . . . 0 N--CA 1.5 2.069 0 N-CA-C 108.174 -1.047 . . . . 2.18 108.174 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . 0.467 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 64.4 tt0 -97.77 122.87 41.38 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.717 -0.846 . . . . 0.4 108.717 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.428 HD11 HG22 ' A' ' 5' ' ' ILE . 28.4 mm -101.3 114.49 40.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 N-CA-C 107.823 -1.177 . . . . 1.04 107.823 179.432 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.467 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 79.9 mm-40 -97.88 0.07 45.95 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.751 -1.218 . . . . 2.25 110.098 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.0 p -154.19 157.75 39.28 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.087 -1.008 . . . . 0.91 110.951 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.14 -33.91 76.49 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.313 -0.995 . . . . 2.18 108.313 178.487 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.1 m -56.37 -47.95 77.85 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.626 -0.83 . . . . 1.03 109.066 -178.776 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.34 -29.58 68.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.199 -0.938 . . . . 1.02 109.28 178.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -59.66 -46.03 90.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.93 -1.106 . . . . 0.15 109.22 -179.315 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -65.52 -42.93 91.5 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.067 -0.716 . . . . 2.07 109.067 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -64.34 -36.09 82.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.719 -0.613 . . . . 1.77 109.819 179.57 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.92 -43.29 79.54 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.407 -0.808 . . . . 1.04 109.538 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.4 -40.0 92.78 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.176 -0.953 . . . . 1.07 108.698 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -69.28 -38.38 78.32 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.658 0.742 . . . . 1.07 109.336 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.29 -35.48 76.07 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.488 0.661 . . . . 1.07 109.909 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.2 -22.19 64.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 1.03 110.462 -178.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -140.99 37.07 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.006 -1.568 . . . . 0.24 109.71 179.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.83 5.16 49.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.379 -1.071 . . . . 1.07 110.688 -179.11 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.0 mttm -74.06 152.29 39.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.878 -1.138 . . . . 2.03 109.676 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.456 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.01 154.76 18.33 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 108.197 -1.038 . . . . 1.23 108.197 -179.37 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.456 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 58.2 t -142.56 113.41 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.987 -1.071 . . . . 1.03 109.358 -179.693 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.45 142.57 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 108.087 -1.079 . . . . 1.03 108.087 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.0 t -125.51 123.16 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.453 -0.779 . . . . 1.01 109.553 -178.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.517 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 35.5 t70 -98.99 119.54 37.94 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 1.05 109.953 179.588 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -96.63 25.82 4.89 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.237 -0.914 . . . . 0.73 109.577 179.433 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -59.99 145.52 45.9 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.146 -0.971 . . . . 0.84 110.23 -178.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.98 124.21 30.81 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.919 -1.141 . . . . 1.04 107.919 179.189 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.1 t -68.24 -29.0 67.71 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 119.29 -0.964 . . . . 1.08 108.585 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.545 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 70.3 p-90 -76.42 -13.74 60.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.023 -1.048 . . . . 0.29 109.881 179.855 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.6 t -90.27 115.64 27.64 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.26 108.596 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.405 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.94 -53.99 40.58 Favored Glycine 0 N--CA 1.489 2.23 0 C-N-CA 120.41 -0.9 . . . . 0.28 111.33 -178.798 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -50.35 -35.55 44.81 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 CA-C-N 118.768 1.284 . . . . 0.5 112.096 -179.835 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.21 -47.16 18.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 1.04 110.008 -179.545 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.93 -32.21 70.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.176 -0.953 . . . . 2.12 109.348 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.502 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.83 -29.19 68.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.551 -0.718 . . . . 2.66 110.243 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 21.4 mt -80.99 -4.41 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.655 -0.653 . . . . 1.22 111.069 -179.036 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.01 -31.76 10.16 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 120.138 -1.601 . . . . 1.44 113.211 -177.409 . . . . . . . . 3 3 . 1 . 030 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.76 -36.38 91.57 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 121.573 1.597 . . . . 0.31 112.162 -178.421 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -72.37 -51.81 18.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 118.953 -1.099 . . . . 0.45 108.498 179.588 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.81 -47.23 86.53 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.391 -0.818 . . . . 0.16 109.056 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -68.36 -43.03 78.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.557 -0.715 . . . . 0.35 110.877 179.667 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.8 m -64.03 -38.23 90.3 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.954 -1.091 . . . . 0.77 110.679 -179.306 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.92 -23.92 66.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.396 -0.815 . . . . 1.07 110.735 -178.376 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.2 m -54.26 -38.05 65.37 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.793 -1.192 . . . . 0.87 108.397 -179.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.63 -17.87 40.07 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.283 -0.886 . . . . 2.16 109.256 178.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -76.34 -36.82 58.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.749 -1.219 . . . . 2.29 108.004 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -123.53 65.69 1.01 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 106.58 -1.637 . . . . 0.95 106.58 178.108 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -62.41 -9.78 9.42 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.53 -0.915 . . . . 0.89 108.53 -179.396 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -89.37 8.9 28.31 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.787 -1.19 . . . . 1.13 107.787 178.727 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.87 145.16 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 N-CA-C 108.161 -1.052 . . . . 1.06 108.161 179.152 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.01 122.47 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.065 -1.022 . . . . 1.04 109.249 -179.12 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -103.68 129.31 50.99 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.169 -0.957 . . . . 0.13 109.521 179.598 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.456 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.6 mp -111.94 142.37 44.43 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.126 -0.984 . . . . 1.08 109.985 179.168 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 107.016 -1.476 . . . . 1.13 107.016 177.732 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.7 t -128.86 134.38 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.477 -0.765 . . . . 1.03 110.748 -177.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 57.9 t0 -95.19 119.8 34.32 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.485 -0.759 . . . . 1.05 109.232 179.614 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.91 -16.68 21.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.575 -1.328 . . . . 1.04 108.306 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.545 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.1 m-20 -94.1 -44.12 8.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.439 -0.788 . . . . 1.08 111.696 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . 0.406 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 68.7 m-20 -95.81 -14.36 23.33 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.728 -1.232 . . . . 1.07 108.654 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.03 38.23 4.24 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 107.364 -1.347 . . . . 1.03 107.364 179.27 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -59.94 -23.17 63.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.758 -0.589 . . . . 1.92 110.065 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.481 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.7 p30 -65.94 -37.58 86.4 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.042 -1.036 . . . . 1.05 108.9 179.171 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.481 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.8 t -71.34 -44.1 72.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.263 -0.898 . . . . 1.1 109.548 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.09 70.57 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.442 -0.786 . . . . 1.03 111.14 -178.449 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.0 p -60.06 -32.88 71.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.084 -1.01 . . . . 0.89 109.157 -179.243 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -60.66 -38.33 84.53 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.958 -0.756 . . . . 2.06 108.958 179.176 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.02 1.4 57.22 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.438 -0.789 . . . . 1.05 110.809 -179.251 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 54.89 50.51 15.45 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.025 -1.047 . . . . 2.02 109.306 -179.328 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 133.1 30.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 118.324 -1.35 . . . . 1.05 107.959 -179.283 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -105.79 -10.99 16.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 2.16 109.917 -179.121 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.27 156.04 23.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.848 -1.157 . . . . 1.04 111.214 -179.654 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 154.36 81.04 Favored Pre-proline 0 N--CA 1.503 2.204 0 N-CA-C 108.263 -1.014 . . . . 1.04 108.263 179.059 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -76.42 141.63 70.69 Favored 'Cis proline' 0 N--CA 1.495 1.588 0 C-N-CA 123.929 -1.28 . . . . 0.19 112.799 -2.505 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -127.47 132.54 49.99 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.648 0.737 . . . . 1.04 109.39 178.832 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.517 ' CE2' ' OD1' ' A' ' 26' ' ' ASP . 88.7 m-85 -108.52 131.75 54.51 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.011 -0.737 . . . . 0.23 109.011 179.979 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -120.72 143.04 48.98 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.395 -0.965 . . . . 0.43 108.395 179.121 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -109.0 133.49 52.91 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 121.708 0.766 . . . . 0.17 110.449 -179.249 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -128.83 143.6 50.95 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 109.383 -0.599 . . . . 0.17 109.383 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . 0.405 ' CB ' ' HZ1' ' A' ' 81' ' ' LYS . 2.5 ttmp? -146.37 125.93 13.3 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.71 -1.589 . . . . 2.18 106.71 178.807 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 58.29 29.42 18.05 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.559 -0.904 . . . . 1.8 108.559 -178.466 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.531 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 77.7 11.73 85.16 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.744 -1.342 . . . . 0.23 109.744 -179.909 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.531 HE21 ' C ' ' A' ' 83' ' ' GLY . 4.5 mm-40 -111.43 132.39 54.5 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.509 -0.994 . . . . 2.75 109.989 -179.053 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -78.41 121.01 23.95 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.048 -1.093 . . . . 2.3 108.048 178.538 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -123.99 11.47 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.777 -0.577 . . . . 1.06 110.627 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -174.2 151.42 12.87 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 118.175 -1.964 . . . . 0.22 112.137 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 3.8 tp10 -163.75 140.22 6.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.923 -0.751 . . . . 1.93 109.218 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.466 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 3.9 p90 -163.87 156.86 18.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.568 -0.707 . . . . 0.16 109.246 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.71 160.25 31.34 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.596 -0.69 . . . . 0.9 110.064 -179.337 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.85 139.43 5.26 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.347 -1.501 . . . . 0.12 109.347 179.465 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.54 63.45 2.06 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.353 -1.086 . . . . 1.04 109.68 -179.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -118.76 102.25 8.68 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.732 -0.84 . . . . 1.36 108.732 178.557 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.7 -36.25 75.77 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.338 -0.851 . . . . 1.6 111.613 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.2 -29.41 69.8 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.844 -1.16 . . . . 1.61 109.472 -179.822 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.489 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 50.5 tttp -60.98 -36.11 78.57 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.591 -0.693 . . . . 2.02 109.205 -179.242 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.1 mt -59.05 -39.93 83.56 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-O 122.1 0.952 . . . . 1.05 108.924 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -63.02 -41.58 99.58 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.074 -0.65 . . . . 2.1 111.077 -178.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.03 -43.25 79.19 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.059 -1.026 . . . . 1.06 111.526 -178.293 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -66.75 -39.94 88.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.858 -1.151 . . . . 1.04 109.892 -178.332 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.93 -48.97 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.237 -1.023 . . . . 1.04 108.237 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -60.16 -35.63 75.74 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.998 0.904 . . . . 1.09 108.675 178.616 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.54 -39.79 85.02 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.994 -0.548 . . . . 2.21 109.956 -177.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.5 mt -99.79 -1.64 37.13 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.258 -0.901 . . . . 1.05 111.189 -179.173 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.401 -1.437 . . . . 1.08 109.12 -179.274 . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 120.817 0.342 . . . . 1.89 110.373 . . . . . . . . . 0 0 . 1 . 030 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 26.5 mm -132.78 142.77 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.523 -0.735 . . . . 1.03 109.149 -179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -103.88 125.86 50.6 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 106.803 -1.554 . . . . 0.19 106.803 177.431 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -79.33 143.85 34.77 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.849 -1.157 . . . . 0.93 111.227 -178.1 . . . . . . . . 1 1 . 1 . 030 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.449 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.3 m95 -75.91 -10.56 59.52 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.229 -0.919 . . . . 0.21 108.718 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . 0.488 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.5 m120 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 108.589 -0.893 . . . . 0.49 108.589 -179.914 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.4 tptp . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 109.065 -0.717 . . . . 2.18 109.065 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -97.03 123.2 40.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.512 -0.742 . . . . 0.4 109.176 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.34 115.53 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.204 -0.935 . . . . 1.04 108.674 178.712 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -98.15 -0.42 44.33 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 2.25 109.344 179.518 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.57 155.6 35.07 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.672 -1.267 . . . . 0.91 111.944 -179.634 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.23 -33.16 74.06 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.138 -1.06 . . . . 2.18 108.138 178.389 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 80.3 m -58.12 -47.83 82.07 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.406 -0.809 . . . . 1.03 109.329 -179.473 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.74 -30.71 68.38 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.154 -0.966 . . . . 1.02 108.623 178.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -59.57 -43.77 93.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.146 -0.971 . . . . 0.15 108.849 -179.372 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -64.24 -43.31 95.32 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.123 -0.695 . . . . 2.07 109.123 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . 0.557 ' OE1' ' N ' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -64.4 -39.34 93.66 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.505 -0.747 . . . . 1.77 110.353 179.957 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.85 -41.22 91.97 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.426 -0.796 . . . . 1.04 108.95 -179.301 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 mt -62.15 -39.99 94.46 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.911 -1.118 . . . . 1.07 108.809 179.414 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.86 -34.8 74.09 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.424 -0.797 . . . . 1.07 109.95 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.45 -36.77 76.93 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.326 -0.859 . . . . 1.07 110.212 -179.606 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.54 80.59 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.229 -0.919 . . . . 1.03 109.373 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.32 -124.58 22.59 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.656 -1.377 . . . . 0.24 109.656 -179.415 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -89.98 2.07 55.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.11 -1.229 . . . . 1.07 110.592 -178.797 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -74.61 150.22 39.74 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.829 -1.169 . . . . 2.03 109.697 -179.933 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.435 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -61.34 156.24 19.41 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.075 -1.454 . . . . 1.23 107.075 179.741 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.435 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 78.7 t -143.46 112.69 2.03 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 120.991 -1.068 . . . . 1.03 108.94 -179.532 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -103.0 138.85 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 108.498 -0.927 . . . . 1.03 108.498 179.776 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.1 t -122.08 119.66 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.488 -0.757 . . . . 1.01 109.16 -179.441 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.571 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.5 t70 -98.99 109.09 21.9 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.525 -0.735 . . . . 1.05 110.344 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -89.95 102.81 15.52 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 106.754 -1.573 . . . . 0.73 106.754 177.548 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.0 m -129.01 146.56 50.95 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.794 -0.817 . . . . 0.84 108.794 -179.743 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.73 122.67 30.15 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.777 -1.194 . . . . 1.04 107.777 179.104 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -65.72 -34.09 77.38 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 118.92 -1.112 . . . . 1.08 108.724 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.486 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 46.2 p-90 -70.73 -23.56 62.46 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.366 -0.833 . . . . 0.29 110.634 179.797 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -84.2 112.97 20.75 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.621 -1.251 . . . . 0.26 107.621 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.494 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.61 -49.16 81.53 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 120.415 -0.898 . . . . 0.28 111.086 -178.298 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.6 Cg_exo -53.46 -35.38 75.77 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 CA-C-N 118.616 1.208 . . . . 0.5 112.704 179.913 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.97 -55.77 5.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.228 -0.92 . . . . 1.04 109.928 -179.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -59.82 -37.43 79.17 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.144 -0.973 . . . . 2.12 109.421 -179.837 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.401 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 37.6 ttm -59.69 -28.95 67.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.995 . . . . 2.66 109.994 -179.618 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . 0.446 ' CG2' ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -80.05 -4.5 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.725 -0.609 . . . . 1.22 110.926 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -65.39 -26.11 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 120.382 -1.449 . . . . 1.44 114.604 -177.548 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.6 Cg_exo -57.56 -37.99 95.25 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 CA-C-N 122.536 1.941 . . . . 0.31 113.148 -176.648 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -69.88 -43.31 72.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.049 -1.46 . . . . 0.45 108.478 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -63.65 -50.57 68.76 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.001 0.905 . . . . 0.16 109.788 179.208 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -68.01 -44.03 77.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 121.237 0.541 . . . . 0.35 109.691 179.701 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.1 m -60.71 -37.15 80.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.983 -1.073 . . . . 0.77 110.498 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -63.48 -22.3 66.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.705 -1.247 . . . . 1.07 110.833 -178.527 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -53.71 -37.4 63.26 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.967 -1.083 . . . . 0.87 108.279 -179.252 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 54.7 mp0 -85.65 -17.73 35.24 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.066 -1.021 . . . . 2.16 109.47 179.708 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.28 -35.71 54.87 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.754 -1.202 . . . . 2.29 107.754 179.228 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -124.94 66.57 1.11 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 106.906 -1.516 . . . . 0.95 106.906 178.025 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -64.2 -7.96 10.88 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.829 -0.804 . . . . 0.89 108.829 -179.129 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -91.09 10.16 27.97 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 108.458 -0.941 . . . . 1.13 108.458 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.7 t -128.03 149.92 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 N-CA-C 107.996 -1.113 . . . . 1.06 107.996 179.392 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.0 mm -100.72 122.19 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.791 -1.193 . . . . 1.04 109.044 -178.839 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -106.95 128.88 54.72 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.071 -1.018 . . . . 0.13 109.33 179.753 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.438 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.9 mp -114.95 142.25 46.87 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.924 -1.11 . . . . 1.08 109.5 179.183 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -111.77 130.13 55.9 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 106.753 -1.573 . . . . 1.13 106.753 177.703 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -126.39 137.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.267 -0.896 . . . . 1.03 111.741 -177.571 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -99.1 119.56 38.04 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.702 -0.851 . . . . 1.05 108.702 179.14 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -70.33 -16.95 20.4 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 O-C-N 120.946 -1.096 . . . . 1.04 108.918 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 4.3 m-20 -95.2 -39.6 10.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 1.08 111.547 -179.376 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -96.24 -17.96 20.38 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 120.832 -1.167 . . . . 1.07 108.216 179.453 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.92 41.2 3.57 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.477 -1.305 . . . . 1.03 107.477 179.031 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.43 -25.67 66.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.831 -0.543 . . . . 1.92 109.697 -178.747 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.1 p30 -62.97 -38.68 92.08 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.912 -1.118 . . . . 1.05 109.162 179.241 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.529 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -70.51 -44.27 77.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 121.193 -0.942 . . . . 1.1 109.868 -179.843 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.01 -37.31 69.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.364 -0.835 . . . . 1.03 111.255 -178.879 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.0 p -60.27 -33.96 73.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.793 -1.192 . . . . 0.89 109.381 -178.865 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.67 -36.57 84.28 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.576 -0.702 . . . . 2.06 109.801 179.615 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.88 -1.95 58.35 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.426 -0.797 . . . . 1.05 111.302 -178.781 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 56.94 48.8 15.14 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.033 -1.042 . . . . 2.02 109.578 -179.288 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.0 t -64.39 129.78 28.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 120.809 -1.182 . . . . 1.05 108.056 -179.828 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -103.04 -11.77 17.9 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.718 -0.613 . . . . 2.16 109.982 -179.387 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.508 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.68 154.24 17.97 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.801 -1.187 . . . . 1.04 110.377 179.767 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 74' ' ' THR . . . . . 0.4 HG21 ' HE1' ' B' ' 67' ' ' TRP . 33.0 p -130.12 155.55 80.58 Favored Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.146 -0.971 . . . . 1.04 108.767 179.039 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -73.56 144.67 81.74 Favored 'Cis proline' 0 N--CA 1.493 1.495 0 C-N-CA 123.934 -1.277 . . . . 0.19 112.999 -2.586 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.4 m -130.1 134.7 47.53 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.033 -1.099 . . . . 1.04 108.033 178.69 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.571 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -109.88 131.25 55.23 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.426 -0.796 . . . . 0.23 109.129 -179.14 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -124.3 140.43 52.97 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.289 -1.004 . . . . 0.43 108.289 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -108.29 135.85 48.91 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 121.436 0.636 . . . . 0.17 110.232 -179.32 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.02 146.53 50.32 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.669 -0.863 . . . . 0.17 108.669 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -143.4 121.64 12.25 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.759 -1.2 . . . . 2.18 107.759 -179.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 60.03 27.35 16.76 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.596 -0.69 . . . . 1.8 109.857 -179.427 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.24 Favored Glycine 0 N--CA 1.495 2.623 0 O-C-N 120.899 -1.126 . . . . 0.23 110.994 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -127.05 142.2 51.59 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.049 -1.265 . . . . 2.75 110.172 -179.781 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . 0.51 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 33.1 ttpt -79.6 126.75 31.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.243 -0.911 . . . . 2.3 108.977 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.5 m -119.98 11.55 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.647 -0.658 . . . . 1.06 110.683 -179.21 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 165.03 157.31 9.61 Favored Glycine 0 N--CA 1.492 2.403 0 C-N-CA 118.501 -1.809 . . . . 0.22 111.492 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.51 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 12.3 pt-20 -165.97 158.11 14.45 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.775 -0.838 . . . . 1.93 109.794 179.231 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -164.09 163.26 23.21 Favored 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 119.27 -0.972 . . . . 0.16 109.976 176.844 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.26 160.73 29.51 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 121.633 0.73 . . . . 0.9 110.175 -179.357 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.58 141.77 7.2 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 108.776 -1.729 . . . . 0.12 108.776 -179.873 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.1 68.5 4.15 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.315 -1.109 . . . . 1.04 111.489 -178.84 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.447 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -117.84 100.4 7.56 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 108.289 -1.004 . . . . 1.36 108.289 177.871 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.03 -33.27 73.35 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.173 -0.954 . . . . 1.6 111.619 -179.263 . . . . . . . . 3 3 . 1 . 031 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.86 -29.06 69.45 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.621 -1.3 . . . . 1.61 110.063 -179.225 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.447 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 43.3 tttp -60.93 -34.31 74.51 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.509 -0.923 . . . . 2.02 108.509 -179.086 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.3 mt -60.13 -40.05 88.43 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.714 0.768 . . . . 1.05 109.008 179.777 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.32 -41.89 98.92 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.988 -0.685 . . . . 2.1 110.836 -177.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.94 -43.96 70.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 1.06 111.454 -178.514 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.6 m -65.3 -39.99 93.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.088 -1.007 . . . . 1.04 109.883 -178.76 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . 0.402 ' O ' ' N ' ' A' ' 105' ' ' VAL . 63.9 mt -61.52 -48.54 88.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 108.002 -1.11 . . . . 1.04 108.002 179.235 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -60.2 -36.36 77.48 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.409 -0.96 . . . . 1.09 108.409 178.727 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.59 85.75 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.637 -0.505 . . . . 2.21 109.637 -178.984 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.9 mt -99.86 -3.15 33.15 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.126 -0.984 . . . . 1.05 111.626 -179.042 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' A' ' 101' ' ' ILE . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.397 -1.439 . . . . 1.08 109.119 -179.518 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm . . . . . 0 N--CA 1.488 1.428 0 N-CA-C 110.228 -0.286 . . . . 1.89 110.228 . . . . . . . . . 0 0 . 1 . 031 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 26.3 mm -129.92 146.99 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 109.543 -0.539 . . . . 1.03 109.543 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 60.9 m -104.59 126.27 51.52 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 107.176 -1.416 . . . . 0.19 107.176 177.848 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.0 m -77.46 138.18 39.09 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.672 -1.267 . . . . 0.93 111.016 -178.567 . . . . . . . . 1 1 . 1 . 031 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.4 ' HE1' HG21 ' A' ' 74' ' ' THR . 19.8 m95 -75.05 -9.63 58.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.012 -1.055 . . . . 0.21 109.556 179.056 . . . . . . . . 2 2 . 1 . 031 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 C--N 1.3 -1.55 0 O-C-N 121.335 -0.853 . . . . 0.49 109.122 -179.891 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 tptm . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 108.238 -1.023 . . . . 2.18 108.238 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -98.13 124.52 42.71 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.21 -0.931 . . . . 0.4 108.96 179.566 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.2 mm -100.92 113.83 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.389 -0.819 . . . . 1.04 108.824 179.165 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -98.47 -0.38 43.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.318 -0.864 . . . . 2.25 109.395 179.077 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -154.33 155.7 35.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.971 -1.081 . . . . 0.91 111.324 179.587 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -62.66 -30.92 71.74 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.247 -1.02 . . . . 2.18 108.247 178.478 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.1 m -59.02 -48.7 80.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.35 -0.94 . . . . 1.03 108.701 -179.573 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.14 -28.8 67.62 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.85 -0.74 . . . . 1.02 109.067 179.079 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -59.89 -43.84 94.55 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.097 -1.002 . . . . 0.15 108.568 -179.683 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.89 -42.17 85.97 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.312 -0.625 . . . . 2.07 109.312 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.8 -37.14 86.6 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.43 0.633 . . . . 1.77 110.046 -179.814 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.06 80.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.289 -0.882 . . . . 1.04 108.999 -179.696 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.2 mt -61.02 -39.84 91.3 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.108 -0.995 . . . . 1.07 108.917 179.528 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.65 -35.27 75.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.532 -0.73 . . . . 1.07 110.2 -179.629 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.05 -37.5 75.57 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.341 -0.849 . . . . 1.07 110.801 -178.952 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.11 72.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.098 -1.002 . . . . 1.03 109.757 -179.503 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.22 20.23 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 110.24 -1.144 . . . . 0.24 110.24 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . 0.499 ' OD1' ' NZ ' ' A' ' 82' ' ' LYS . 70.7 m-20 -90.7 1.76 56.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.157 -1.201 . . . . 1.07 110.554 -178.48 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -75.73 150.12 37.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.014 -1.054 . . . . 2.03 110.251 -178.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.427 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.93 154.26 22.81 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 107.605 -1.257 . . . . 1.23 107.605 -179.665 . . . . . . . . 3 3 . 1 . 032 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.427 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 90.4 t -144.41 116.13 2.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.057 -1.027 . . . . 1.03 108.646 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.2 t -105.08 142.6 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 107.959 -1.126 . . . . 1.03 107.959 179.497 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -125.31 123.17 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 O-C-N 121.179 -0.951 . . . . 1.01 109.514 -179.233 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.558 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 32.8 t70 -100.64 120.07 39.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.343 -0.848 . . . . 1.05 110.427 179.303 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -97.29 25.58 5.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.335 -0.853 . . . . 0.73 110.336 179.315 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.3 m -59.47 146.62 39.63 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.923 -1.111 . . . . 0.84 110.061 -178.662 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.15 126.84 33.04 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.699 -1.223 . . . . 1.04 107.699 179.34 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 t -68.06 -34.92 77.34 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.148 -1.021 . . . . 1.08 108.365 -179.841 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.54 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 53.8 p-90 -69.86 -22.34 63.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.43 -0.794 . . . . 0.29 110.539 179.576 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.7 t -85.11 106.49 16.61 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.526 -1.287 . . . . 0.26 107.526 179.695 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.518 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.83 -46.85 92.92 Favored Glycine 0 N--CA 1.487 2.08 0 C-N-CA 120.363 -0.922 . . . . 0.28 111.084 -178.469 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -52.35 -36.21 67.82 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.942 1.371 . . . . 0.5 111.663 179.682 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.16 -49.4 13.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.493 -0.754 . . . . 1.04 109.954 179.98 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -59.9 -31.55 69.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.232 -0.918 . . . . 2.12 109.276 179.894 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.519 ' O ' ' SD ' ' A' ' 37' ' ' MET . 12.7 tmm? -59.91 -29.79 68.6 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.252 -0.905 . . . . 2.66 109.587 -179.465 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 mt -81.55 -8.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.532 -0.73 . . . . 1.22 111.34 -179.186 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.517 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.5 ptmt -61.67 -28.38 3.95 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 120.27 -1.519 . . . . 1.44 113.621 -177.253 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.9 Cg_exo -57.63 -37.84 95.51 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 122.696 1.999 . . . . 0.31 112.178 -176.828 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -68.57 -47.72 66.07 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.601 -1.24 . . . . 0.45 108.113 179.306 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -60.34 -52.12 66.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.669 -0.644 . . . . 0.16 109.674 178.752 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -68.2 -40.28 82.2 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.478 -0.764 . . . . 0.35 110.836 -179.724 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.9 m -62.81 -39.08 93.18 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.952 -1.093 . . . . 0.77 110.666 -179.802 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.5 mt -63.18 -23.9 67.64 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.163 -0.961 . . . . 1.07 111.044 -178.383 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -53.33 -36.78 61.66 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 120.712 -1.243 . . . . 0.87 108.699 -179.18 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.2 mp0 -87.24 -14.02 42.2 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.267 -0.896 . . . . 2.16 109.179 179.395 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.29 -38.07 36.23 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.152 -1.425 . . . . 2.29 107.152 178.908 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . 0.434 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 76.3 m-85 -121.74 68.28 0.91 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 106.856 -1.535 . . . . 0.95 106.856 178.002 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.66 -9.07 12.0 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.748 -0.834 . . . . 0.89 108.748 -179.331 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.04 7.18 36.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.875 -1.157 . . . . 1.13 107.875 178.861 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.9 t -127.45 144.82 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 107.791 -1.189 . . . . 1.06 107.791 178.777 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.6 mm -100.02 121.05 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.027 -1.046 . . . . 1.04 109.419 -178.804 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -102.06 125.54 48.77 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.16 -0.963 . . . . 0.13 109.2 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.476 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 6.7 mp -108.63 140.87 41.39 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.04 -1.038 . . . . 1.08 109.361 179.613 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -108.92 132.07 54.42 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.273 -1.751 . . . . 1.13 106.273 177.978 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 42.5 t -130.72 133.61 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.295 -0.878 . . . . 1.03 110.76 -177.659 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -96.02 119.0 33.73 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.865 -0.791 . . . . 1.05 108.865 179.681 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.25 -16.82 21.5 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 O-C-N 120.524 -1.36 . . . . 1.04 108.784 179.319 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.54 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.3 m-20 -94.78 -40.19 9.89 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.433 -0.792 . . . . 1.08 111.623 -178.467 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -98.09 -15.46 19.97 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.826 -1.171 . . . . 1.07 107.938 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.89 38.47 4.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.621 -1.251 . . . . 1.03 107.621 179.389 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -59.88 -27.74 66.96 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.731 -0.605 . . . . 1.92 109.859 -178.608 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -64.03 -36.0 82.55 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.686 -1.259 . . . . 1.05 109.155 179.591 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.484 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 5.7 t -71.76 -44.06 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.309 -0.869 . . . . 1.1 109.622 179.914 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.75 69.04 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.384 -0.822 . . . . 1.03 110.287 -179.187 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -60.11 -30.47 69.28 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.197 -0.94 . . . . 0.89 108.97 -179.442 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -60.54 -39.92 89.64 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.909 -0.775 . . . . 2.06 108.909 178.881 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -91.46 0.93 57.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.28 -0.887 . . . . 1.05 110.717 -179.309 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 55.76 49.97 15.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.992 -1.068 . . . . 2.02 109.134 -178.945 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -62.8 130.51 27.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 C-N-CA 118.323 -1.351 . . . . 1.05 108.363 -178.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -102.22 -10.63 19.41 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.656 -0.652 . . . . 2.16 109.889 -178.933 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.47 156.09 18.24 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.698 -1.251 . . . . 1.04 111.129 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -126.79 155.66 74.93 Favored Pre-proline 0 N--CA 1.497 1.903 0 N-CA-C 107.699 -1.222 . . . . 1.04 107.699 178.309 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -76.84 140.1 63.24 Favored 'Cis proline' 0 N--CA 1.492 1.411 0 C-N-CA 123.63 -1.404 . . . . 0.19 112.271 -2.275 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.0 m -125.14 132.52 53.07 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.816 -0.809 . . . . 1.04 108.816 177.799 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.558 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.4 m-85 -110.51 131.4 55.08 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.752 -0.832 . . . . 0.23 108.752 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -122.89 139.13 54.37 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.322 -0.861 . . . . 0.43 109.11 179.465 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -105.12 136.21 45.03 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.332 0.586 . . . . 0.17 110.401 -179.392 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -129.07 146.99 50.89 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 109.258 -0.645 . . . . 0.17 109.258 179.362 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -145.93 122.67 11.21 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.615 -1.254 . . . . 2.18 107.615 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . 0.499 ' NZ ' ' OD1' ' A' ' 20' ' ' ASP . 55.3 mttm 56.71 34.49 24.68 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.998 -1.064 . . . . 1.8 109.043 -177.945 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.22 20.44 79.65 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 109.894 -1.282 . . . . 0.23 109.894 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -123.96 132.13 53.67 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.369 -1.077 . . . . 2.75 110.794 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -79.02 124.01 27.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.422 -0.799 . . . . 2.3 109.021 178.923 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.82 9.27 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.656 -0.652 . . . . 1.06 110.977 -179.634 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.85 155.43 15.53 Favored Glycine 0 N--CA 1.495 2.586 0 C-N-CA 118.244 -1.931 . . . . 0.22 111.569 -179.616 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -166.78 148.73 6.28 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.818 -0.813 . . . . 1.93 109.549 179.512 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 10.4 p90 -163.91 159.5 21.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.16 109.377 178.348 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.3 p -125.79 162.31 25.4 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.044 -0.724 . . . . 0.9 109.044 -179.525 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.11 139.78 5.67 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.586 -1.406 . . . . 0.12 109.586 179.831 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 63.6 1.93 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.453 -1.028 . . . . 1.04 110.338 -179.64 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.2 t-20 -119.12 99.93 7.02 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.531 -0.914 . . . . 1.36 108.531 178.541 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.8 -31.43 69.33 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 1.6 111.597 -179.201 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.14 -28.87 69.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.779 -1.201 . . . . 1.61 109.763 -179.589 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . 0.428 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 77.1 tttt -61.19 -34.97 75.92 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.655 -0.868 . . . . 2.02 108.655 -179.432 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.1 mt -59.97 -39.85 87.08 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 122.124 0.964 . . . . 1.05 108.478 179.01 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . 0.434 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 36.8 tp10 -61.18 -41.46 96.83 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.853 -0.612 . . . . 2.1 111.293 -178.115 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.36 73.0 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.851 -1.156 . . . . 1.06 112.168 -178.082 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.9 m -66.56 -39.7 88.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.73 -1.232 . . . . 1.04 110.142 -178.485 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.4 mt -60.18 -50.59 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.106 -0.996 . . . . 1.04 108.699 179.897 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -61.5 -33.62 74.1 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.694 -0.854 . . . . 1.09 108.694 179.189 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -68.1 -41.38 81.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 2.21 110.69 -178.956 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.4 mt -97.64 -2.14 42.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -0.925 . . . . 1.05 110.951 -178.683 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.624 -1.298 . . . . 1.08 109.222 -179.526 . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.256 -0.646 . . . . 1.89 109.256 . . . . . . . . . 0 0 . 1 . 032 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 38.5 mm -128.83 140.37 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 N-CA-C 109.411 -0.589 . . . . 1.03 109.411 179.845 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.8 m -100.97 126.79 47.65 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.492 -1.299 . . . . 0.19 107.492 177.549 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.8 m -79.01 140.82 37.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.781 -1.2 . . . . 0.93 110.909 -178.512 . . . . . . . . 1 1 . 1 . 032 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . 0.425 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.1 m95 -74.27 -10.01 59.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.898 . . . . 0.21 109.578 179.499 . . . . . . . . 2 2 . 1 . 032 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.488 1.47 0 O-C-N 121.137 -0.977 . . . . 0.49 108.457 -179.869 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.2 tttp . . . . . 0 N--CA 1.496 1.85 0 N-CA-C 108.81 -0.811 . . . . 2.18 108.81 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -97.86 126.1 43.07 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.237 -1.023 . . . . 0.4 108.237 179.464 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.4 mm -100.04 112.06 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.262 -1.014 . . . . 1.04 108.262 179.795 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -96.48 -0.38 49.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.13 -0.981 . . . . 2.25 109.727 -179.655 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -153.19 155.43 36.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.967 -1.083 . . . . 0.91 110.841 179.765 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -64.25 -33.34 75.6 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 107.981 -1.118 . . . . 2.18 107.981 178.545 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 37.1 m -57.08 -48.23 79.1 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.49 -0.93 . . . . 1.03 108.49 -179.361 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.22 -29.25 68.04 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.83 . . . . 1.02 109.125 178.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.04 -44.64 94.52 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -0.949 . . . . 0.15 108.731 -179.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -65.38 -43.57 90.29 Favored 'General case' 0 C--N 1.297 -1.704 0 C-N-CA 119.64 -0.824 . . . . 2.07 109.031 179.631 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.8 -36.34 84.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.4 -0.813 . . . . 1.77 110.282 179.383 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -43.24 79.34 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.454 -0.779 . . . . 1.04 108.975 -179.503 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.2 mt -60.37 -40.22 90.07 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.027 -1.101 . . . . 1.07 108.027 179.709 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.32 -34.64 74.95 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.281 -0.887 . . . . 1.07 109.861 179.841 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.2 -36.24 79.26 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.45 -0.781 . . . . 1.07 110.472 -179.109 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.12 -30.75 71.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.215 -0.928 . . . . 1.03 109.208 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.43 -126.44 25.1 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 109.358 -1.497 . . . . 0.24 109.358 -179.618 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -91.69 3.54 54.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.32 -1.106 . . . . 1.07 110.804 -179.273 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -74.86 149.45 39.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.663 -1.273 . . . . 2.03 108.995 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.516 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.59 160.14 5.82 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 106.992 -1.484 . . . . 1.23 106.992 179.369 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.516 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 95.7 t -147.5 119.63 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 O-C-N 120.962 -1.086 . . . . 1.03 108.321 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.4 t -106.91 142.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 107.721 -1.214 . . . . 1.03 107.721 179.267 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.9 t -124.64 120.2 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.349 -0.844 . . . . 1.01 108.913 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . 0.567 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.4 t70 -98.61 108.71 21.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.331 -0.856 . . . . 1.05 111.628 -179.319 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -90.1 101.01 13.73 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.4 -1.704 . . . . 0.73 106.4 176.602 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 28' ' ' SER . . . . . 0.435 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 55.3 m -129.94 145.59 51.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.955 -1.128 . . . . 0.84 107.955 -179.66 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.15 122.98 29.59 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.567 -1.272 . . . . 1.04 107.567 179.474 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -63.3 -29.3 70.65 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.887 -1.153 . . . . 1.08 107.887 -179.859 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.542 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 69.6 p-90 -78.97 -10.95 59.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.475 -0.766 . . . . 0.29 111.144 -179.887 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.6 t -87.63 116.29 25.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.709 -1.244 . . . . 0.26 108.53 -179.674 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.47 -52.81 50.29 Favored Glycine 0 N--CA 1.487 2.068 0 C-N-CA 120.84 -0.695 . . . . 0.28 112.002 -178.472 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.6 Cg_endo -60.33 -28.87 87.66 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 CA-C-N 119.742 1.771 . . . . 0.5 113.148 -179.685 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.89 -47.46 21.11 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.721 -1.237 . . . . 1.04 110.018 -179.735 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -59.98 -32.27 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.293 -0.879 . . . . 2.12 109.411 179.601 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.501 ' O ' ' SD ' ' A' ' 37' ' ' MET . 18.3 tmm? -60.11 -29.64 68.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.591 -0.693 . . . . 2.66 109.639 -179.934 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.9 mt -81.59 -5.79 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.791 -0.568 . . . . 1.22 111.282 -179.107 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.559 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.62 -31.04 8.52 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 119.896 -1.753 . . . . 1.44 113.427 -177.927 . . . . . . . . 3 3 . 1 . 033 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.1 Cg_exo -60.04 -40.54 60.32 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 CA-C-N 121.297 1.499 . . . . 0.31 112.821 -178.204 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -70.17 -47.91 59.56 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.746 -1.222 . . . . 0.45 108.673 179.798 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.58 -50.66 72.64 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.302 -0.874 . . . . 0.16 109.004 179.481 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -67.85 -40.24 83.7 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.699 -0.625 . . . . 0.35 111.276 179.187 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.45 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.3 m -63.58 -39.31 94.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.647 -1.283 . . . . 0.77 110.635 -179.342 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.3 mt -60.13 -27.15 66.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.396 -0.815 . . . . 1.07 110.909 -178.571 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.5 m -50.09 -37.5 34.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.975 -1.078 . . . . 0.87 108.986 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.2 mp0 -87.59 -16.75 33.66 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.205 -0.935 . . . . 2.16 108.942 179.698 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -77.73 -35.99 51.32 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.316 -1.365 . . . . 2.29 107.316 179.462 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -124.28 69.21 1.07 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.261 -1.385 . . . . 0.95 107.261 177.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.0 p -65.66 -8.97 23.39 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.729 -0.841 . . . . 0.89 108.729 -179.511 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -91.13 10.15 28.12 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.72 146.42 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.706 -1.22 . . . . 1.06 107.706 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.93 121.43 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.818 -1.176 . . . . 1.04 109.78 -178.949 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -102.78 124.2 47.87 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.255 -0.903 . . . . 0.13 109.999 179.916 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.476 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 4.2 mp -110.18 142.7 41.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.266 -0.896 . . . . 1.08 109.017 178.872 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -113.02 130.32 56.18 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 106.738 -1.578 . . . . 1.13 106.738 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.77 134.18 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.051 -1.031 . . . . 1.03 111.171 -177.777 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . 0.479 ' O ' ' N ' ' A' ' 62' ' ' ALA . 53.5 t0 -98.97 119.44 37.75 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.499 -0.926 . . . . 1.05 108.499 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.6 m -69.09 -17.7 22.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 O-C-N 120.734 -1.229 . . . . 1.04 108.889 179.349 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.0 m-20 -92.64 -39.95 11.02 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.44 -0.788 . . . . 1.08 110.939 -179.079 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -98.5 -12.25 21.47 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.864 -1.148 . . . . 1.07 107.935 178.976 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -127.58 39.33 3.9 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.285 -1.376 . . . . 1.03 107.285 179.3 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -59.78 -27.74 66.81 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 115.868 -0.606 . . . . 1.92 109.385 -178.757 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.69 -38.14 88.41 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.187 -0.946 . . . . 1.05 109.329 179.353 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.527 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 8.9 t -69.72 -44.15 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.121 -0.987 . . . . 1.1 109.364 -179.917 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.36 -39.14 71.46 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.743 -0.598 . . . . 1.03 110.592 -179.036 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -61.17 -36.35 79.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.038 -1.039 . . . . 0.89 109.844 -179.01 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -61.98 -37.19 83.88 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.09 -1.006 . . . . 2.06 109.392 179.431 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.71 -0.88 57.73 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.342 -0.849 . . . . 1.05 111.364 -178.672 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 56.3 52.2 10.49 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.203 -0.936 . . . . 2.02 109.438 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.7 t -66.48 130.94 32.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 118.371 -1.332 . . . . 1.05 108.575 -179.169 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -104.06 -11.01 17.61 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.681 -0.637 . . . . 2.16 109.522 -179.422 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.454 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.54 154.28 16.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.878 -1.139 . . . . 1.04 110.938 179.906 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.8 p -129.63 156.08 79.31 Favored Pre-proline 0 N--CA 1.499 1.988 0 N-CA-C 106.828 -1.545 . . . . 1.04 106.828 178.447 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -76.16 140.94 68.69 Favored 'Cis proline' 0 N--CA 1.49 1.292 0 C-N-CA 123.818 -1.326 . . . . 0.19 111.788 -3.04 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.9 m -128.46 135.1 49.0 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.68 -0.859 . . . . 1.04 108.68 178.784 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.567 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.3 m-85 -108.83 128.83 55.24 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.873 -0.788 . . . . 0.23 108.873 -179.43 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -121.15 140.02 52.56 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.62 -1.252 . . . . 0.43 107.62 178.773 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -107.72 135.08 49.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.257 0.551 . . . . 0.17 110.241 -178.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -126.88 147.23 50.07 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.165 -0.68 . . . . 0.17 109.165 178.985 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -146.16 125.08 12.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 106.986 -1.487 . . . . 2.18 106.986 179.378 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 57.97 27.1 14.26 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.099 -1.074 . . . . 1.8 108.099 -178.296 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . 0.412 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 80.53 11.3 84.26 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.112 -1.195 . . . . 0.23 110.112 179.944 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . 0.412 HE21 ' C ' ' A' ' 83' ' ' GLY . 5.3 mm-40 -112.98 133.39 54.96 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.511 -0.994 . . . . 2.75 110.253 -179.26 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -81.47 120.02 24.47 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.583 -0.895 . . . . 2.3 108.583 178.858 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.6 m -121.76 13.01 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.857 -0.527 . . . . 1.06 110.517 -179.288 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.59 154.79 14.29 Favored Glycine 0 N--CA 1.496 2.687 0 C-N-CA 118.304 -1.903 . . . . 0.22 112.284 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -167.2 150.6 6.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.656 -0.908 . . . . 1.93 109.816 179.397 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -164.47 160.21 20.26 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 119.284 -0.966 . . . . 0.16 109.102 177.082 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.77 161.49 27.23 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.445 -0.784 . . . . 0.9 110.52 -179.055 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.51 138.91 5.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.574 -1.41 . . . . 0.12 109.574 179.16 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.05 67.17 1.7 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.269 -1.136 . . . . 1.04 109.765 -179.588 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.89 96.97 5.47 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.813 -0.81 . . . . 1.36 108.813 178.877 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -33.43 71.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.173 -0.954 . . . . 1.6 111.72 -179.55 . . . . . . . . 2 2 . 1 . 033 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -62.97 -30.2 71.4 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.693 -1.255 . . . . 1.61 108.641 -179.85 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -60.61 -36.59 78.96 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.449 0.643 . . . . 2.02 109.498 -179.844 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.05 -37.94 78.21 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.982 0.896 . . . . 1.05 108.624 179.886 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -62.89 -42.39 99.76 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 120.128 -0.629 . . . . 2.1 110.851 -177.815 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.88 -43.47 68.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.051 -1.03 . . . . 1.06 111.655 -178.399 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -64.65 -39.95 94.58 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.701 -1.249 . . . . 1.04 110.506 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.17 -48.89 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.15 -1.055 . . . . 1.04 108.15 179.252 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -60.69 -34.03 73.74 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.543 -0.91 . . . . 1.09 108.543 178.904 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -68.01 -39.29 83.21 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.669 -0.645 . . . . 2.21 110.282 -178.883 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.5 mt -100.37 -3.72 30.56 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.407 -0.808 . . . . 1.05 110.978 -178.706 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.4 p . . . . . 0 N--CA 1.495 1.803 0 O-C-N 120.552 -1.343 . . . . 1.08 108.658 -179.762 . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt . . . . . 0 N--CA 1.492 1.664 0 N-CA-C 108.873 -0.788 . . . . 1.89 108.873 . . . . . . . . . 0 0 . 1 . 033 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 36.1 mm -127.97 140.69 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 N-CA-C 109.199 -0.667 . . . . 1.03 109.199 -179.954 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.5 m -97.56 122.39 40.58 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 107.165 -1.42 . . . . 0.19 107.165 177.558 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.2 m -77.79 140.3 39.42 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.85 -1.156 . . . . 0.93 111.851 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 26.3 m95 -74.7 -11.98 60.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -0.9 . . . . 0.21 109.685 179.236 . . . . . . . . 1 1 . 1 . 033 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 m120 . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.134 -0.979 . . . . 0.49 108.546 179.826 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.2 tptt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 108.372 -0.973 . . . . 2.18 108.372 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -96.63 122.79 39.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.239 -0.913 . . . . 0.4 108.856 -179.876 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.7 mm -100.62 111.55 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 1.04 108.678 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.448 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.2 mp0 -96.55 0.5 50.18 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.15 -0.969 . . . . 2.25 109.884 -179.421 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.1 p -154.13 156.12 36.63 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.026 -1.046 . . . . 0.91 111.04 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -64.74 -33.29 75.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.438 -0.949 . . . . 2.18 108.438 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 51.6 m -57.38 -46.31 83.55 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.48 -0.933 . . . . 1.03 108.48 -179.136 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 -31.85 70.37 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.903 -0.777 . . . . 1.02 108.903 178.689 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -58.52 -43.73 89.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.304 -0.873 . . . . 0.15 109.046 -179.527 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -66.21 -42.76 88.29 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.529 -0.868 . . . . 2.07 108.891 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -63.63 -39.51 94.53 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.644 -0.66 . . . . 1.77 110.82 179.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.96 82.59 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.154 -0.966 . . . . 1.04 109.24 -179.659 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.7 mt -61.09 -40.15 92.63 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.087 -1.079 . . . . 1.07 108.087 179.218 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.04 -37.13 78.41 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.769 -0.582 . . . . 1.07 110.513 179.72 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.09 -36.03 79.13 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.146 -0.971 . . . . 1.07 110.27 -178.924 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.7 72.55 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.078 -1.014 . . . . 1.03 109.09 179.827 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.66 -124.02 23.45 Favored Glycine 0 N--CA 1.484 1.9 0 N-CA-C 109.417 -1.473 . . . . 0.24 109.417 -179.853 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -92.14 3.89 54.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.242 -1.152 . . . . 1.07 110.983 -179.301 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -75.8 148.71 38.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.751 -1.218 . . . . 2.03 109.118 -179.914 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.482 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.7 158.56 12.45 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 107.137 -1.431 . . . . 1.23 107.137 179.759 . . . . . . . . 3 3 . 1 . 034 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.482 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 44.1 t -146.24 119.2 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 120.651 -1.281 . . . . 1.03 108.732 179.654 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.52 140.99 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.664 -1.236 . . . . 1.03 107.664 179.045 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.6 t -123.54 121.95 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.439 -0.788 . . . . 1.01 109.483 -179.075 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -100.14 120.26 39.6 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.493 -0.754 . . . . 1.05 109.919 179.883 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 23.31 7.16 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.257 -0.902 . . . . 0.73 110.137 179.507 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.0 m -57.43 146.26 30.08 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.032 -1.043 . . . . 0.84 110.639 -178.731 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.47 124.76 31.71 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 107.709 -1.219 . . . . 1.04 107.709 178.991 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -67.9 -33.59 75.0 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 118.657 -1.217 . . . . 1.08 108.453 -179.627 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 52.5 p-90 -70.04 -24.16 63.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.289 -0.882 . . . . 0.29 110.944 179.488 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.2 t -83.44 119.75 25.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.86 -1.15 . . . . 0.26 107.994 -179.456 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.449 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.58 -52.15 52.94 Favored Glycine 0 N--CA 1.49 2.241 0 C-N-CA 120.397 -0.906 . . . . 0.28 110.883 -178.383 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.9 Cg_exo -52.06 -37.39 68.35 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 CA-C-N 118.571 1.185 . . . . 0.5 112.635 179.59 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.38 -51.45 10.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.304 -0.873 . . . . 1.04 109.831 -179.808 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -60.07 -35.44 75.16 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.216 -0.928 . . . . 2.12 109.706 179.678 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.499 ' O ' ' SD ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.39 -27.74 66.27 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.502 -0.749 . . . . 2.66 109.789 -179.726 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 59.9 mt -87.86 -0.84 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.644 -0.66 . . . . 1.22 111.157 -178.786 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.583 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 1.5 ptmt -64.84 -31.36 5.4 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.299 -1.501 . . . . 1.44 112.904 -178.69 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.6 Cg_exo -56.42 -39.4 91.55 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 CA-C-N 121.026 1.402 . . . . 0.31 113.277 -177.767 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -67.99 -47.23 69.12 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.279 -1.369 . . . . 0.45 108.292 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -60.14 -53.0 62.95 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.778 0.799 . . . . 0.16 110.155 178.805 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -68.63 -40.3 80.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.72 -0.613 . . . . 0.35 111.188 -179.42 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.1 m -62.62 -40.02 95.67 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.958 -1.089 . . . . 0.77 110.769 -179.45 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -63.12 -20.87 65.77 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.307 -0.871 . . . . 1.07 110.371 -178.493 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -52.08 -39.82 60.27 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 120.759 -1.213 . . . . 0.87 108.718 -178.982 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -82.74 -17.83 42.9 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.231 -0.918 . . . . 2.16 109.596 179.246 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -76.81 -35.99 57.23 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.675 -1.266 . . . . 2.29 107.816 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -123.37 67.98 1.0 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 106.564 -1.643 . . . . 0.95 106.564 177.445 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -10.44 15.33 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.934 -0.765 . . . . 0.89 108.934 -179.265 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -89.83 8.25 32.95 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.869 -0.789 . . . . 1.13 108.869 179.481 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.7 t -126.64 147.26 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 107.539 -1.282 . . . . 1.06 107.539 178.617 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . 0.408 HG22 HD11 ' A' ' 53' ' ' ILE . 27.1 mm -100.27 123.45 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.015 -1.053 . . . . 1.04 109.342 -178.658 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -106.09 123.96 48.83 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.136 -0.977 . . . . 0.13 109.689 179.569 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.445 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.6 mp -110.0 140.16 44.31 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.077 -1.014 . . . . 1.08 109.652 178.936 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -109.93 131.45 55.05 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 106.942 -1.503 . . . . 1.13 106.942 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.79 135.25 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.428 -0.795 . . . . 1.03 110.576 -177.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -97.49 119.71 36.53 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.19 -1.041 . . . . 1.05 108.19 179.186 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -68.38 -18.47 23.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.635 -1.291 . . . . 1.04 108.672 179.693 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.3 -40.76 10.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.384 -0.823 . . . . 1.08 111.505 -178.764 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.28 -13.69 23.18 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.717 -1.24 . . . . 1.07 108.106 179.516 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.59 37.83 4.29 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.426 -1.324 . . . . 1.03 107.426 179.164 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -59.7 -23.67 63.32 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.812 -0.81 . . . . 1.92 108.812 -178.757 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.2 p30 -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.979 -1.076 . . . . 1.05 108.757 178.811 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . 0.469 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 4.5 t -71.18 -46.88 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 CA-C-O 121.619 0.723 . . . . 1.1 109.88 179.873 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.48 -37.14 68.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.668 -0.645 . . . . 1.03 110.597 -178.643 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -60.09 -37.43 79.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.154 -0.967 . . . . 0.89 109.466 -179.293 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.28 -33.92 76.83 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.401 -0.812 . . . . 2.06 109.099 179.163 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.92 0.45 53.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.504 -0.747 . . . . 1.05 110.402 -179.34 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.7 mp0 53.14 50.05 18.63 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 2.02 110.379 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.4 t -67.99 134.41 30.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 O-C-N 120.59 -1.319 . . . . 1.05 108.74 -179.897 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -105.21 -12.94 15.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.548 -0.72 . . . . 2.16 109.844 -179.609 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.511 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.96 158.22 19.42 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.925 -1.11 . . . . 1.04 110.584 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.9 p -129.94 155.29 80.82 Favored Pre-proline 0 N--CA 1.502 2.169 0 N-CA-C 108.494 -0.928 . . . . 1.04 108.494 179.248 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -75.14 140.15 65.57 Favored 'Cis proline' 0 N--CA 1.497 1.734 0 C-N-CA 123.871 -1.304 . . . . 0.19 113.157 -2.112 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 90.0 m -125.39 130.34 51.69 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.263 -1.014 . . . . 1.04 108.263 178.163 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 91.9 m-85 -109.16 131.16 55.33 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 108.669 -0.863 . . . . 0.23 108.669 -179.529 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -123.0 141.91 51.43 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.347 -0.845 . . . . 0.43 108.743 179.764 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -108.1 135.12 49.99 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.558 0.694 . . . . 0.17 110.741 -179.001 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -129.87 143.57 50.87 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.125 -0.695 . . . . 0.17 109.125 179.253 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -147.19 130.98 17.0 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 107.167 -1.42 . . . . 2.18 107.167 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 70.5 mttt 58.83 26.1 14.39 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.697 -0.853 . . . . 1.8 108.697 -178.403 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.15 22.13 71.83 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.949 -1.26 . . . . 0.23 109.949 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -129.71 141.52 50.88 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.356 -1.085 . . . . 2.75 110.406 -179.845 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -79.39 125.47 29.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.271 -0.893 . . . . 2.3 109.466 179.664 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 m -123.66 11.24 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.763 -0.586 . . . . 1.06 110.296 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.51 157.98 20.87 Favored Glycine 0 N--CA 1.497 2.701 0 C-N-CA 118.602 -1.761 . . . . 0.22 111.523 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . 0.472 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.1 tp10 -167.23 148.64 5.75 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.775 -0.838 . . . . 1.93 109.146 179.578 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.472 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.5 p90 -169.28 156.93 7.23 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.504 -0.748 . . . . 0.16 109.936 178.108 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.3 p -126.48 163.63 22.92 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.484 -0.76 . . . . 0.9 109.646 -179.588 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.85 142.48 6.69 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.324 -1.511 . . . . 0.12 109.324 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.68 65.67 3.22 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.316 -1.108 . . . . 1.04 110.1 -179.542 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.04 96.03 5.06 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.367 -0.975 . . . . 1.36 108.367 178.653 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -32.34 72.25 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 1.6 111.373 -179.287 . . . . . . . . 2 2 . 1 . 034 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.36 -30.05 70.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.829 -1.17 . . . . 1.61 109.765 -179.566 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.42 -34.19 73.59 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.07 -0.715 . . . . 2.02 109.07 -179.035 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.91 -39.38 85.2 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.158 0.98 . . . . 1.05 108.571 179.226 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -60.68 -44.02 97.0 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 120.174 -0.61 . . . . 2.1 110.826 -178.324 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.62 -44.02 71.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 1.06 111.603 -178.203 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.0 m -64.0 -39.92 95.19 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 120.853 -1.154 . . . . 1.04 109.683 -178.864 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.84 -49.48 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 N-CA-C 108.077 -1.083 . . . . 1.04 108.077 178.876 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -60.18 -35.23 74.9 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.257 -1.016 . . . . 1.09 108.257 179.166 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -68.0 -40.07 83.09 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.436 -0.79 . . . . 2.21 110.616 -179.188 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.78 -3.44 35.61 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.232 -0.917 . . . . 1.05 111.185 -178.533 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.589 -1.319 . . . . 1.08 109.105 -179.758 . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 109.692 -0.484 . . . . 1.89 109.692 . . . . . . . . . 0 0 . 1 . 034 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 29.8 mm -130.02 142.01 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.677 -0.639 . . . . 1.03 109.856 -179.208 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.5 m -101.27 129.28 47.21 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.538 -1.282 . . . . 0.19 107.538 177.961 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 58.5 m -78.72 140.61 38.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.851 -1.156 . . . . 0.93 110.644 -178.897 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 18.5 m95 -76.15 -10.11 59.16 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.801 -1.187 . . . . 0.21 109.566 178.972 . . . . . . . . 1 1 . 1 . 034 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--N 1.303 -1.453 0 O-C-N 121.184 -0.947 . . . . 0.49 108.558 -179.683 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 tptp . . . . . 0 N--CA 1.496 1.86 0 N-CA-C 108.524 -0.917 . . . . 2.18 108.524 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -97.66 124.33 41.92 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.177 -0.952 . . . . 0.4 108.699 179.679 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -103.27 113.81 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 N-CA-C 108.787 -0.82 . . . . 1.04 108.787 179.426 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.417 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.3 mp0 -96.09 -1.05 49.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.993 . . . . 2.25 110.092 -179.463 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -155.49 156.66 35.63 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.885 -1.135 . . . . 0.91 111.376 -179.816 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 8' ' ' LYS . . . . . 0.492 ' HZ3' ' CD ' ' A' ' 68' ' ' GLU . 14.5 ttmm -64.08 -31.96 73.35 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.456 -0.942 . . . . 2.18 108.456 178.658 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.0 m -56.72 -49.07 76.27 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.276 -0.97 . . . . 1.03 108.559 -179.478 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -30.72 69.01 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.48 -0.763 . . . . 1.02 109.21 178.782 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -59.67 -42.53 93.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.15 108.875 -179.354 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -65.77 -42.5 90.77 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.31 -0.996 . . . . 2.07 108.31 179.533 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -64.27 -37.33 87.09 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.285 0.564 . . . . 1.77 110.173 179.497 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.95 77.75 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.266 -0.896 . . . . 1.04 108.986 -179.477 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.6 mt -60.72 -40.79 93.66 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.516 -0.873 . . . . 1.07 108.668 179.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -68.66 -38.1 80.15 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 1.07 110.238 179.573 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.81 -37.31 84.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.347 -0.845 . . . . 1.07 110.201 -178.694 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.83 73.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.026 -1.046 . . . . 1.03 109.385 179.893 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -124.48 22.48 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.897 -1.281 . . . . 0.24 109.897 -179.6 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.24 4.48 52.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.398 -1.06 . . . . 1.07 110.149 -179.206 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -75.79 147.74 38.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.973 -1.079 . . . . 2.03 108.848 -179.673 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.52 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.51 159.56 6.3 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 107.387 -1.338 . . . . 1.23 107.387 -179.392 . . . . . . . . 3 3 . 1 . 035 nuclear orig core ' A' A ' 23' ' ' VAL . . . . . 0.52 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 67.1 t -148.48 118.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 120.964 -1.085 . . . . 1.03 108.097 179.578 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 t -106.48 142.73 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.912 -1.144 . . . . 1.03 107.912 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.0 t -125.92 122.46 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.414 -0.804 . . . . 1.01 109.82 -178.76 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -99.09 118.85 36.77 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.303 -0.873 . . . . 1.05 109.456 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -94.79 20.49 8.66 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.155 -0.966 . . . . 0.73 109.285 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -55.94 147.87 18.56 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 120.974 -1.079 . . . . 0.84 110.276 -178.623 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.51 126.03 32.93 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.398 -1.334 . . . . 1.04 107.398 178.61 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -69.07 -32.02 71.17 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.661 -1.215 . . . . 1.08 107.829 179.395 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 31' ' ' TRP . . . . . 0.499 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 62.8 p-90 -70.42 -22.42 62.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.69 -0.631 . . . . 0.29 110.98 179.81 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.2 t -84.74 115.33 22.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.788 -1.195 . . . . 0.26 108.239 -179.772 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 33' ' ' GLY . . . . . 0.445 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.29 -51.89 55.16 Favored Glycine 0 N--CA 1.488 2.15 0 C-N-CA 120.437 -0.887 . . . . 0.28 111.391 -178.397 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.2 Cg_exo -51.81 -35.45 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 CA-C-N 118.809 1.305 . . . . 0.5 111.325 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.98 -50.29 13.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.531 -0.731 . . . . 1.04 110.09 -179.747 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -59.81 -34.95 73.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.086 -1.009 . . . . 2.12 109.026 -179.765 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 37' ' ' MET . . . . . 0.54 ' O ' ' SD ' ' A' ' 37' ' ' MET . 10.1 tmm? -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.403 -0.81 . . . . 2.66 109.313 179.917 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 74.9 mt -84.95 -1.99 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.588 -0.695 . . . . 1.22 111.603 -178.938 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 39' ' ' LYS . . . . . 0.574 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 18.2 pttt -65.44 -30.11 3.82 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 120.168 -1.582 . . . . 1.44 113.26 -178.627 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 40' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.2 Cg_exo -55.08 -40.06 87.76 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 121.403 1.537 . . . . 0.31 112.533 -177.067 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.26 -45.04 74.24 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 118.367 -1.333 . . . . 0.45 108.35 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.13 -51.63 67.08 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.21 -0.931 . . . . 0.16 109.697 179.36 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -67.33 -41.84 84.59 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.524 0.678 . . . . 0.35 110.741 179.841 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 44' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.3 m -62.22 -39.94 94.44 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.273 -0.892 . . . . 0.77 110.195 -179.287 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.74 -23.14 64.72 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.344 -0.848 . . . . 1.07 110.613 -179.023 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.2 m -53.36 -35.38 60.2 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.801 -1.187 . . . . 0.87 108.849 -179.254 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . 0.534 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.3 mp0 -88.88 -13.38 39.31 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.195 -0.941 . . . . 2.16 108.959 179.198 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -77.77 -39.97 42.37 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.814 -1.18 . . . . 2.29 107.814 178.698 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -123.87 69.6 1.06 Allowed 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.741 -1.577 . . . . 0.95 106.741 178.058 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.35 -9.07 10.41 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.543 -0.91 . . . . 0.89 108.543 -179.32 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -89.68 8.03 33.66 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.202 -1.036 . . . . 1.13 108.202 179.146 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 56.0 t -126.45 142.74 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 N-CA-C 107.996 -1.113 . . . . 1.06 107.996 179.114 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.7 mm -97.88 121.31 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.217 -0.927 . . . . 1.04 109.65 -178.995 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -101.63 125.4 48.28 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.391 -0.818 . . . . 0.13 109.385 179.551 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.427 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.9 mp -110.28 144.85 38.37 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.075 -1.016 . . . . 1.08 110.097 179.14 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -112.52 131.51 55.56 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.216 -1.402 . . . . 1.13 107.216 177.825 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -128.21 132.08 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.404 -0.81 . . . . 1.03 109.744 -178.849 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -95.11 120.0 34.57 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.872 -0.788 . . . . 1.05 108.872 179.873 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -64.99 -19.84 26.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.813 0 O-C-N 120.378 -1.451 . . . . 1.04 107.876 179.199 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 60' ' ' ASP . . . . . 0.499 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 28.5 m-20 -92.64 -41.67 10.06 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.457 -0.777 . . . . 1.08 112.403 -178.746 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -95.67 -18.23 20.67 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.36 -1.463 . . . . 1.07 108.99 -179.576 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.82 40.7 3.66 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.735 -1.209 . . . . 1.03 107.735 179.029 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -60.18 -19.13 52.63 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.469 -0.567 . . . . 1.92 109.469 -179.161 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -62.22 -39.43 92.76 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.985 -1.072 . . . . 1.05 108.849 179.87 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.69 -43.98 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 O-C-N 121.274 -0.891 . . . . 1.1 109.849 -179.973 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.37 -40.57 81.39 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.396 -0.815 . . . . 1.03 110.471 -178.273 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.6 p -60.32 -39.29 86.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.048 -1.032 . . . . 0.89 109.177 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 68' ' ' GLU . . . . . 0.492 ' CD ' ' HZ3' ' A' ' 8' ' ' LYS . 40.4 tt0 -62.97 -38.99 93.34 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.337 -0.852 . . . . 2.06 109.832 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.68 -2.5 58.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.437 -0.789 . . . . 1.05 111.179 -178.416 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 56.03 49.15 16.26 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.163 -0.96 . . . . 2.02 109.947 -179.913 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.84 132.47 28.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 118.586 -1.246 . . . . 1.05 108.038 -179.617 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -105.26 -12.17 16.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.478 -0.764 . . . . 2.16 110.173 -179.039 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 73' ' ' ALA . . . . . 0.465 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.86 156.22 17.44 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.829 -1.169 . . . . 1.04 111.071 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -127.72 156.28 75.89 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 107.966 -1.124 . . . . 1.04 107.966 179.087 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -74.36 143.39 77.68 Favored 'Cis proline' 0 N--CA 1.494 1.547 0 C-N-CA 123.85 -1.312 . . . . 0.19 112.851 -3.682 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 76' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -128.24 133.7 48.87 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.492 -0.929 . . . . 1.04 108.492 177.926 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -111.46 131.69 55.03 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 108.803 -0.814 . . . . 0.23 108.803 -179.236 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -122.96 140.61 52.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.43 109.161 179.457 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -108.28 135.55 49.42 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.309 0.576 . . . . 0.17 110.448 -179.207 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -126.32 149.16 49.35 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.43 0.633 . . . . 0.17 109.434 179.341 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -146.76 126.41 13.37 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 106.964 -1.495 . . . . 2.18 106.964 -179.734 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.9 mttp 54.02 34.08 18.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.938 -1.101 . . . . 1.8 108.677 -177.987 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.64 20.71 79.72 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 110.017 -1.233 . . . . 0.23 110.017 179.568 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -124.45 133.5 53.35 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.427 -1.043 . . . . 2.75 110.611 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -78.4 124.06 27.69 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.241 -0.912 . . . . 2.3 109.732 179.657 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.4 m -123.99 10.8 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.663 -0.648 . . . . 1.06 110.522 -179.578 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.83 151.26 10.6 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 118.564 -1.779 . . . . 0.22 111.451 -179.819 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -164.92 148.01 8.48 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.815 -0.815 . . . . 1.93 109.045 179.285 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 89' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 11.1 p90 -164.19 159.03 19.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.198 -0.939 . . . . 0.16 110.025 178.16 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.24 159.98 31.56 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.58 0.705 . . . . 0.9 109.786 -179.529 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.37 143.0 6.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.241 -1.544 . . . . 0.12 109.241 179.099 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.39 66.58 2.47 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.258 -1.142 . . . . 1.04 109.606 -179.879 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.84 92.51 3.8 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 108.175 -1.046 . . . . 1.36 108.175 178.909 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.97 -32.53 73.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.445 -0.784 . . . . 1.6 111.196 -179.093 . . . . . . . . 2 2 . 1 . 035 nuclear orig core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -63.92 -30.8 71.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.035 -1.041 . . . . 1.61 109.521 -179.619 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.36 -35.33 75.44 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 109.215 -0.661 . . . . 2.02 109.215 -179.003 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.86 -38.88 83.38 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.562 -0.903 . . . . 1.05 108.562 179.106 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.47 -43.75 98.31 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 120.261 -0.576 . . . . 2.1 110.673 -178.029 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.88 -43.81 71.07 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.211 -0.931 . . . . 1.06 111.543 -178.768 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -64.17 -39.93 95.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.868 -1.145 . . . . 1.04 110.18 -178.585 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.3 mt -61.39 -48.97 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 108.162 -1.051 . . . . 1.04 108.162 179.118 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -60.63 -34.62 74.55 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.389 -0.967 . . . . 1.09 108.389 179.448 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -68.03 -39.93 83.02 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.532 -0.73 . . . . 2.21 110.909 -178.587 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 88.0 mt -100.17 0.22 40.09 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.108 -0.995 . . . . 1.05 111.141 -178.333 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.683 -1.26 . . . . 1.08 109.464 -179.489 . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 109.132 -0.692 . . . . 1.89 109.132 . . . . . . . . . 0 0 . 1 . 035 nuclear orig core ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 28.9 mm -135.85 142.43 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 N-CA-C 109.406 -0.59 . . . . 1.03 109.406 -179.649 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 9.4 m -101.71 127.2 48.58 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 107.543 -1.28 . . . . 0.19 107.543 177.634 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.1 m -78.81 139.94 38.29 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.865 -1.147 . . . . 0.93 111.562 -178.291 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -72.94 -8.75 57.08 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.912 -0.773 . . . . 0.21 108.912 178.283 . . . . . . . . 1 1 . 1 . 035 nuclear orig core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 C--N 1.301 -1.516 0 N-CA-C 108.794 -0.817 . . . . 0.49 108.794 179.37 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mmm . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.219 0.533 . . . . 3.32 109.685 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.0 t -98.92 138.86 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.273 0 O-C-N 121.434 -0.791 . . . . 1.16 109.739 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -130.59 127.55 39.25 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 2.18 109.296 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -94.64 123.22 37.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.4 108.748 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.9 mm -99.87 116.47 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.896 -1.15 . . . . 1.04 107.896 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.516 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 55.1 mp0 -99.48 -1.08 39.36 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.34 -0.85 . . . . 2.25 109.274 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.454 ' HG ' ' H ' ' A' ' 10' ' ' ALA . 80.0 p -155.74 156.49 34.94 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.988 -1.07 . . . . 0.91 111.481 -179.679 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -63.34 -31.45 72.61 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.332 -0.988 . . . . 2.18 108.332 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 87.1 m -59.51 -47.52 85.22 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.729 -0.841 . . . . 1.03 108.729 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.454 ' H ' ' HG ' ' A' ' 7' ' ' SER . . . -67.97 -30.5 69.8 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.381 -0.825 . . . . 1.02 108.909 178.914 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -59.81 -41.42 91.21 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.378 -0.826 . . . . 0.15 109.276 -179.866 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -66.78 -41.88 86.97 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.769 -0.826 . . . . 2.07 108.769 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.27 -40.45 93.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.825 -0.547 . . . . 1.77 110.686 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.27 87.38 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.244 -0.91 . . . . 1.04 109.278 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 70.8 mt -61.71 -39.95 93.33 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.868 -1.145 . . . . 1.07 108.574 179.694 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.99 -35.32 74.32 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.641 -0.662 . . . . 1.07 109.945 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.1 -36.48 79.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.24 -0.912 . . . . 1.07 109.901 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.4 -33.06 74.72 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 1.03 109.455 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.92 -127.28 24.82 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 109.583 -1.407 . . . . 0.24 109.583 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.493 ' CG ' ' HZ2' ' A' ' 82' ' ' LYS . 69.2 m-20 -90.02 2.17 55.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.258 . . . . 1.07 110.456 -178.805 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -75.22 150.09 38.72 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.906 -1.121 . . . . 2.03 110.171 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.437 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.6 155.21 15.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 107.395 -1.335 . . . . 1.23 107.395 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.437 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 89.5 t -142.38 110.43 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.187 -0.946 . . . . 1.03 108.954 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.1 t -97.37 142.58 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 N-CA-C 108.28 -1.007 . . . . 1.03 108.28 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.1 t -124.48 124.61 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.191 -0.943 . . . . 1.01 109.49 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.531 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -101.97 118.17 36.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.488 -0.757 . . . . 1.05 109.963 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.487 ' CE2' ' NE2' ' A' ' 78' ' ' GLN . 67.0 m-85 -95.8 21.63 8.28 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.288 -0.882 . . . . 0.73 109.531 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -57.5 148.59 23.3 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.926 -1.109 . . . . 0.84 110.697 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.04 123.93 32.66 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.054 -1.091 . . . . 1.04 108.054 178.783 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.6 t -67.94 -31.38 71.1 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.783 -1.167 . . . . 1.08 108.303 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.492 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 53.9 p-90 -71.05 -24.27 62.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.578 -0.701 . . . . 0.29 110.645 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -85.18 119.31 25.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.942 -1.098 . . . . 0.26 108.101 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.438 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.31 -53.22 47.37 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 111.134 -0.786 . . . . 0.28 111.134 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.6 Cg_exo -53.05 -37.16 78.68 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 CA-C-N 118.515 1.158 . . . . 0.5 112.344 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.6 6.63 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.487 -0.758 . . . . 1.04 110.083 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.84 -36.74 77.46 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.01 -1.056 . . . . 2.12 109.813 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.513 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.11 -29.73 67.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -0.798 . . . . 2.66 110.244 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 52.3 mt -83.89 0.45 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.439 -0.788 . . . . 1.22 110.999 -179.128 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.566 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 12.9 ptmt -68.03 -28.52 1.89 Allowed Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 120.57 -1.331 . . . . 1.44 113.406 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.566 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.3 Cg_exo -53.03 -39.61 79.06 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 CA-C-N 121.857 1.699 . . . . 0.31 112.92 -176.8 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -69.13 -45.17 70.78 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 118.438 -1.305 . . . . 0.45 108.735 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -60.21 -52.97 63.05 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.132 -0.98 . . . . 0.16 109.694 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -68.71 -44.25 74.28 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.623 -0.673 . . . . 0.35 110.726 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.483 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 54.4 m -60.64 -39.7 89.26 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.059 -1.026 . . . . 0.77 111.186 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -64.53 -19.65 65.73 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.963 -1.086 . . . . 1.07 110.945 -177.716 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -49.87 -39.84 40.68 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.902 -1.124 . . . . 0.87 108.66 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -84.53 -13.82 50.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.69 -1.257 . . . . 2.16 109.485 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -76.44 -36.29 58.04 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.613 -1.254 . . . . 2.29 107.613 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -125.85 68.88 1.18 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.023 -1.473 . . . . 0.95 107.023 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -64.28 -7.95 11.16 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.509 -0.745 . . . . 0.89 109.113 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -91.48 8.99 33.74 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.898 -1.149 . . . . 1.13 107.898 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 38.8 t -128.0 141.82 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 107.875 -1.157 . . . . 1.06 107.875 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.426 HG22 HD11 ' A' ' 53' ' ' ILE . 25.8 mm -99.62 121.55 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.189 -0.945 . . . . 1.04 109.708 -178.571 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.7 m-85 -101.19 127.51 47.72 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.272 -0.893 . . . . 0.13 109.869 179.82 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.467 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.1 mp -109.89 141.03 43.18 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.306 -0.871 . . . . 1.08 108.812 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -109.51 131.24 55.25 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 106.677 -1.601 . . . . 1.13 106.677 177.731 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -128.67 131.99 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.438 -0.789 . . . . 1.03 110.638 -177.976 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.418 ' O ' ' N ' ' A' ' 62' ' ' ALA . 40.2 t0 -96.01 120.12 35.73 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.828 -0.804 . . . . 1.05 108.828 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.5 m -67.89 -19.03 24.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 O-C-N 120.456 -1.402 . . . . 1.04 108.513 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.492 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 12.0 m-20 -92.58 -44.22 8.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.377 -0.827 . . . . 1.08 111.529 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -94.23 -15.16 24.81 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.757 -1.214 . . . . 1.07 108.259 179.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.88 4.09 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.023 -1.102 . . . . 1.03 108.023 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -60.09 -26.54 66.28 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.59 -0.694 . . . . 1.92 110.35 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.1 -37.91 89.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.785 -1.197 . . . . 1.05 108.952 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.51 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 4.4 t -70.31 -44.24 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 121.275 -0.891 . . . . 1.1 109.249 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.8 -40.31 76.03 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.763 -0.586 . . . . 1.03 110.341 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.7 p -61.14 -33.59 73.64 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.199 -0.938 . . . . 0.89 109.222 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -60.36 -39.58 87.69 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.254 -0.904 . . . . 2.06 108.791 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . 0.428 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -89.82 -1.49 58.0 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.349 -0.844 . . . . 1.05 110.913 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 55.68 49.92 15.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.183 -0.948 . . . . 2.02 109.605 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.7 t -61.52 128.9 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 120.663 -1.273 . . . . 1.05 109.021 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -101.34 -10.91 19.85 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.712 -0.618 . . . . 2.16 110.045 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.61 155.99 17.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.689 -1.257 . . . . 1.04 110.459 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 33.9 p -129.22 154.05 80.51 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.075 -1.083 . . . . 1.04 108.075 178.693 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -75.53 141.65 71.79 Favored 'Cis proline' 0 N--CA 1.495 1.595 0 C-N-CA 123.862 -1.307 . . . . 0.19 113.148 -1.932 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.75 131.61 47.87 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.544 -0.91 . . . . 1.04 108.544 178.118 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.531 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.6 m-85 -108.82 130.65 55.4 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 109.001 -0.74 . . . . 0.23 109.001 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.487 ' NE2' ' CE2' ' A' ' 27' ' ' PHE . 70.9 mt-30 -122.81 140.48 52.88 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.247 -0.908 . . . . 0.43 108.601 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.2 m-85 -107.78 136.03 48.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.762 -0.586 . . . . 0.17 110.228 -179.012 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -127.1 149.22 50.04 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.023 -0.732 . . . . 0.17 109.023 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -145.77 120.48 9.85 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.772 -1.196 . . . . 2.18 107.772 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.493 ' HZ2' ' CG ' ' A' ' 20' ' ' ASP . 52.8 mttm 59.38 30.73 20.48 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.629 -1.248 . . . . 1.8 107.629 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.21 15.79 81.17 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.654 -1.378 . . . . 0.23 109.654 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -114.53 131.64 56.59 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.461 -1.023 . . . . 2.75 110.574 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -77.93 120.13 22.36 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.211 -0.93 . . . . 2.3 108.913 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.9 m -122.85 12.45 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.512 -0.742 . . . . 1.06 111.025 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.82 151.17 9.36 Favored Glycine 0 N--CA 1.49 2.297 0 C-N-CA 118.445 -1.836 . . . . 0.22 110.992 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.5 tm-20 -164.34 149.57 10.24 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.833 -0.804 . . . . 1.93 109.207 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 13.1 p90 -164.04 160.14 21.4 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.063 -1.055 . . . . 0.16 109.338 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.24 161.72 27.08 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.49 0.662 . . . . 0.9 109.749 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.98 141.04 5.82 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.542 -1.423 . . . . 0.12 109.542 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.06 66.4 2.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 1.04 109.903 -179.526 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.11 94.21 4.31 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.51 -0.744 . . . . 1.36 109.51 178.609 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -31.64 72.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.062 -1.024 . . . . 1.6 111.539 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.99 -30.37 70.91 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.612 -1.305 . . . . 1.61 109.806 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -59.92 -34.33 73.06 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.627 0.727 . . . . 2.02 109.837 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.59 -39.09 83.01 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 122.046 0.927 . . . . 1.05 108.693 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.42 -44.19 97.04 Favored 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 120.111 -0.636 . . . . 2.1 110.4 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.57 -43.29 69.74 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.22 -0.925 . . . . 1.06 111.365 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.56 -40.37 95.45 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.978 -1.076 . . . . 1.04 108.939 -178.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.6 mt -61.29 -46.08 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 106.843 -1.54 . . . . 1.04 106.843 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 16.9 t-20 -60.48 -35.82 76.82 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.748 -0.834 . . . . 1.09 108.748 178.392 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -68.57 -39.95 80.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.547 -0.721 . . . . 2.21 110.111 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 80.2 mt -98.96 -0.09 42.88 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.107 -0.995 . . . . 1.05 111.624 -178.624 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.619 -1.3 . . . . 1.08 109.682 -179.51 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 N--CA 1.492 1.385 0 CA-C-O 121.186 0.411 . . . . 1.75 111.987 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -101.39 119.19 38.39 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.303 -0.873 . . . . 1.35 108.664 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 22.1 m -108.19 128.6 54.85 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.333 -0.854 . . . . 1.36 108.988 -179.838 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 79.5 mt -63.01 -29.46 70.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.119 -0.988 . . . . 1.24 109.404 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm -67.81 -16.95 64.35 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.568 -0.708 . . . . 1.89 109.509 -179.452 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 29.9 mm -128.99 141.19 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.737 -0.602 . . . . 1.03 109.844 -179.189 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.4 m -100.48 128.47 46.53 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.616 -1.624 . . . . 0.19 106.616 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -82.37 143.01 31.53 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.72 -1.238 . . . . 0.93 111.724 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.489 ' C ' ' H ' ' B' ' 69' ' ' VAL . 25.1 m95 -76.25 -13.31 60.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.565 -0.709 . . . . 0.21 109.33 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -55.2 -11.58 0.77 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.865 -1.161 . . . . 0.49 107.865 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.489 ' H ' ' C ' ' B' ' 67' ' ' TRP . 31.2 m -66.71 140.31 19.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 N-CA-C 109.313 -0.625 . . . . 1.66 109.313 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -59.96 -39.51 85.85 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.313 -0.867 . . . . 1.36 109.245 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.118 -1.593 . . . . 2.32 109.118 179.537 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.149 0.5 . . . . 3.32 109.756 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t -99.65 142.6 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.332 0 O-C-N 121.235 -0.915 . . . . 1.16 109.292 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -130.84 127.16 38.04 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.182 -0.949 . . . . 2.18 109.476 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -95.27 124.73 39.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.242 -0.911 . . . . 0.4 109.301 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mm -101.47 116.39 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.288 -1.004 . . . . 1.04 108.288 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -98.55 -3.54 36.16 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.009 -1.057 . . . . 2.25 109.721 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -152.26 159.93 43.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.863 -1.148 . . . . 0.91 110.975 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -63.98 -34.33 77.75 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.83 -1.174 . . . . 2.18 107.83 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -56.61 -46.22 81.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.49 -0.929 . . . . 1.03 108.49 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.56 -31.0 68.92 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.652 -0.87 . . . . 1.02 108.652 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 45.5 t80 -60.03 -43.3 95.4 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.105 -0.997 . . . . 0.15 108.936 -179.872 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -66.56 -43.19 85.72 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.915 -0.772 . . . . 2.07 108.915 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -62.49 -40.72 97.59 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.583 -0.698 . . . . 1.77 110.622 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.11 -40.33 86.84 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.85 -1.157 . . . . 1.04 108.684 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.8 mt -60.76 -40.86 94.03 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 1.07 108.203 179.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -70.08 -34.5 73.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.318 -0.864 . . . . 1.07 109.592 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.8 75.18 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.643 -0.661 . . . . 1.07 110.202 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.09 71.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.185 -0.947 . . . . 1.03 109.71 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.78 -127.57 25.51 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 110.455 -1.058 . . . . 0.24 110.455 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -90.79 2.42 56.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.918 -1.342 . . . . 1.07 110.307 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.5 mttt -74.05 150.69 40.47 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.005 -1.059 . . . . 2.03 110.011 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.462 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.29 156.45 15.57 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.287 -1.375 . . . . 1.23 107.287 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.462 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 65.6 t -143.97 111.54 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.75 -1.219 . . . . 1.03 109.483 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.4 t -100.69 141.47 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 108.046 -1.094 . . . . 1.03 108.046 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.9 t -124.64 121.51 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.307 -0.871 . . . . 1.01 109.622 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -98.71 121.13 40.26 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.307 -0.871 . . . . 1.05 109.917 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.24 19.69 11.51 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.963 -1.086 . . . . 0.73 110.129 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.2 m -54.3 143.29 23.7 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.047 -1.033 . . . . 0.84 110.595 -178.486 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.0 129.43 34.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.031 -1.1 . . . . 1.04 108.031 179.018 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -68.62 -32.29 72.06 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.987 -1.07 . . . . 1.08 108.997 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.509 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 54.4 p-90 -73.59 -21.54 60.3 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.598 -0.841 . . . . 0.29 110.803 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.8 t -84.66 113.14 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.099 -1.001 . . . . 0.26 108.594 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.435 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.26 -51.99 55.41 Favored Glycine 0 N--CA 1.486 2.007 0 C-N-CA 120.698 -0.763 . . . . 0.28 111.334 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 33.0 Cg_exo -50.31 -36.31 46.89 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 CA-C-N 119.002 1.401 . . . . 0.5 112.056 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.88 -46.19 19.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.39 -0.818 . . . . 1.04 109.148 179.504 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -59.28 -32.9 70.46 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.08 -1.013 . . . . 2.12 109.003 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.467 ' O ' ' SD ' ' A' ' 37' ' ' MET . 12.1 tmm? -59.15 -27.75 65.94 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.635 -0.666 . . . . 2.66 110.133 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.8 mt -83.58 -5.9 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.492 -0.755 . . . . 1.22 110.952 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.545 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.15 -31.56 9.56 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 119.62 -1.925 . . . . 1.44 113.32 -176.959 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.6 Cg_exo -59.68 -40.2 66.87 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 CA-C-N 121.347 1.517 . . . . 0.31 112.129 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.77 -1.172 . . . . 0.45 109.481 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -61.15 -50.63 72.42 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.229 -0.919 . . . . 0.16 109.317 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -67.99 -41.7 81.88 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-O 121.156 0.503 . . . . 0.35 110.974 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.2 m -64.72 -37.76 88.69 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.051 -1.031 . . . . 0.77 110.392 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.54 -23.67 67.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.444 -0.785 . . . . 1.07 110.62 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.9 m -53.14 -39.88 63.83 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.724 -1.235 . . . . 0.87 108.064 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -82.9 -17.77 42.54 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.421 -0.8 . . . . 2.16 109.292 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -75.65 -37.3 59.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.95 -1.5 . . . . 2.29 106.95 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -122.03 68.48 0.93 Allowed 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.977 -1.49 . . . . 0.95 106.977 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -63.59 -11.05 21.64 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.815 -0.809 . . . . 0.89 108.815 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -89.97 8.77 30.72 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.414 -0.958 . . . . 1.13 108.414 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 45.6 t -127.56 146.09 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.355 -0.98 . . . . 1.06 108.355 179.347 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -99.96 122.31 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.033 -1.042 . . . . 1.04 109.451 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 46.9 m-85 -103.73 127.95 51.15 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.272 -0.892 . . . . 0.13 109.164 179.344 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.464 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 3.8 mp -111.35 139.95 46.34 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.249 -0.907 . . . . 1.08 109.153 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -111.87 129.89 56.01 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 106.828 -1.545 . . . . 1.13 106.828 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.1 t -127.25 139.12 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.608 -0.682 . . . . 1.03 110.851 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.409 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 56.8 t0 -99.22 118.38 35.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.598 -0.89 . . . . 1.05 108.598 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.05 -18.41 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 120.257 -1.527 . . . . 1.04 108.608 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.509 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.8 m-20 -92.27 -43.11 9.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.494 -0.754 . . . . 1.08 111.566 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.2 m-20 -95.66 -16.66 21.88 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.719 -1.238 . . . . 1.07 108.701 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.1 37.78 4.29 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.632 -1.247 . . . . 1.03 107.632 179.599 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -59.93 -20.48 57.66 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 1.92 110.154 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.51 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -66.97 -36.77 82.94 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.969 -1.082 . . . . 1.05 108.464 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.51 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.9 t -72.45 -45.65 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.424 -0.798 . . . . 1.1 109.742 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.87 -36.65 70.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.542 -0.724 . . . . 1.03 111.328 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.1 p -60.47 -37.02 79.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.212 . . . . 0.89 109.184 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.6 -35.48 80.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.495 -0.753 . . . . 2.06 109.369 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.27 -1.29 57.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.383 -0.823 . . . . 1.05 110.772 -179.08 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mp0 54.87 49.87 16.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.215 -0.928 . . . . 2.02 109.846 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.51 135.88 27.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 120.915 -1.116 . . . . 1.05 108.562 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -107.41 -15.46 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.71 -0.619 . . . . 2.16 109.836 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.5 154.49 22.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.897 -1.127 . . . . 1.04 111.333 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -124.52 155.7 68.71 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 107.954 -1.128 . . . . 1.04 107.954 178.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -77.22 141.39 68.53 Favored 'Cis proline' 0 N--CA 1.495 1.567 0 C-N-CA 123.769 -1.346 . . . . 0.19 113.025 -2.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.2 m -125.87 130.73 51.92 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.644 -0.872 . . . . 1.04 108.644 177.804 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -108.77 131.44 54.95 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.759 -0.83 . . . . 0.23 108.759 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -122.97 143.48 49.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.35 -0.982 . . . . 0.43 108.35 179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -109.71 134.11 52.37 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.334 0.588 . . . . 0.17 110.594 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -126.83 148.76 49.95 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.406 -0.59 . . . . 0.17 109.406 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -147.2 127.61 14.02 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.926 -1.138 . . . . 2.18 107.926 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 53.48 33.58 16.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.91 -1.119 . . . . 1.8 108.296 -178.724 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.49 20.17 79.65 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.201 -1.16 . . . . 0.23 110.201 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -124.07 134.06 53.48 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.351 -1.088 . . . . 2.75 111.088 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -77.9 126.17 30.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.418 -0.801 . . . . 2.3 109.25 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.7 m -124.12 4.35 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.637 -0.664 . . . . 1.06 111.038 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.67 160.63 25.97 Favored Glycine 0 N--CA 1.496 2.669 0 C-N-CA 118.14 -1.981 . . . . 0.22 111.581 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -168.56 148.02 4.41 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 122.088 -0.654 . . . . 1.93 109.882 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -162.06 160.1 27.06 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.277 -0.889 . . . . 0.16 109.118 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -126.1 160.82 29.11 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.486 0.66 . . . . 0.9 109.991 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.36 143.28 6.44 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.014 -1.635 . . . . 0.12 109.014 179.357 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.4 65.71 3.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.044 -1.268 . . . . 1.04 109.877 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.06 97.07 5.62 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.622 -0.881 . . . . 1.36 108.622 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.44 -33.53 73.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.489 -0.757 . . . . 1.6 111.384 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.86 -29.97 71.1 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 1.61 109.239 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -60.53 -36.93 79.6 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-O 121.439 0.638 . . . . 2.02 109.51 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 53.9 mt -57.82 -39.75 78.38 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 122.084 0.945 . . . . 1.05 108.499 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -60.98 -43.43 98.82 Favored 'General case' 0 C--N 1.289 -2.047 0 C-N-CA 119.904 -0.718 . . . . 2.1 110.879 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.28 -43.86 76.81 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.206 -0.934 . . . . 1.06 111.507 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.5 m -65.3 -40.3 93.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.709 -1.244 . . . . 1.04 109.706 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.95 -49.58 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 N-CA-C 108.196 -1.039 . . . . 1.04 108.196 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.3 t-20 -60.29 -36.04 76.94 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.923 0.868 . . . . 1.09 108.678 179.131 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -67.44 -39.98 85.42 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.808 -0.558 . . . . 2.21 110.091 -178.723 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.7 mt -100.88 2.61 41.09 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.299 -0.875 . . . . 1.05 111.17 -179.095 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.423 -1.423 . . . . 1.08 109.263 -179.609 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 N--CA 1.494 1.537 0 CA-C-O 121.195 0.415 . . . . 1.75 112.272 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -97.47 119.82 36.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.504 -0.748 . . . . 1.35 109.084 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.9 m -104.76 129.95 52.92 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.513 -0.742 . . . . 1.36 109.023 179.989 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -65.49 -30.91 71.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.354 -0.842 . . . . 1.24 109.095 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -63.28 -21.24 66.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.26 -0.9 . . . . 1.89 110.407 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 31.5 mm -129.91 139.91 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.672 -0.643 . . . . 1.03 109.424 -179.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.0 m -101.03 132.05 46.63 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 106.88 -1.526 . . . . 0.19 106.88 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m -83.93 140.01 32.22 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.603 -1.311 . . . . 0.93 111.219 -177.817 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.421 ' C ' ' H ' ' B' ' 69' ' ' VAL . 20.6 m95 -73.15 -8.65 56.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.223 -0.923 . . . . 0.21 109.921 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -55.29 -11.65 0.82 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.949 -1.095 . . . . 0.49 108.917 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.421 ' H ' ' C ' ' B' ' 67' ' ' TRP . 16.8 m -60.23 139.18 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.238 -0.914 . . . . 1.66 109.21 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -59.99 -40.38 88.97 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.193 -0.942 . . . . 1.36 109.174 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.037 0 N-CA-C 109.016 -1.634 . . . . 2.32 109.016 -179.694 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.9 mmm . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.389 -0.596 . . . . 3.32 109.389 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 63.1 t -99.03 136.32 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.466 -0.771 . . . . 1.16 109.104 -179.974 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -131.18 129.94 42.36 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.243 -0.911 . . . . 2.18 108.796 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -98.72 124.1 43.35 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 0.4 108.884 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -102.8 115.08 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 108.666 -0.864 . . . . 1.04 108.666 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -97.79 -0.05 45.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.16 -0.962 . . . . 2.25 110.173 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.12 154.22 34.36 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.869 -1.144 . . . . 0.91 111.01 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -63.64 -32.39 73.85 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.175 -1.046 . . . . 2.18 108.175 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 47.6 m -57.24 -48.43 78.85 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.179 -1.008 . . . . 1.03 108.596 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.75 -31.01 69.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.36 -0.837 . . . . 1.02 109.163 178.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -59.45 -44.03 93.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.159 -0.963 . . . . 0.15 109.006 -179.883 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -65.56 -40.88 93.33 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.705 -0.85 . . . . 2.07 108.705 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.34 -37.12 86.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.555 -0.716 . . . . 1.77 110.327 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.76 -42.34 81.91 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.327 -0.858 . . . . 1.04 109.054 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.0 mt -60.73 -40.35 92.04 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.609 -0.885 . . . . 1.07 108.609 179.775 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -70.04 -38.5 75.85 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.632 -0.667 . . . . 1.07 110.275 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.3 -37.38 80.58 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.254 -0.904 . . . . 1.07 109.988 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.85 69.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.204 -0.935 . . . . 1.03 109.303 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.03 -127.28 30.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.931 -1.268 . . . . 0.24 109.931 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -89.92 1.34 56.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.263 -1.139 . . . . 1.07 110.689 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttt -73.34 150.0 42.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.788 -1.195 . . . . 2.03 109.493 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.463 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.48 156.29 16.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 107.472 -1.307 . . . . 1.23 107.472 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.463 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 84.4 t -143.34 111.33 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.132 -0.98 . . . . 1.03 108.992 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.89 140.57 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.135 -1.061 . . . . 1.03 108.135 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.53 123.96 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.325 -0.859 . . . . 1.01 109.249 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.523 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 27.4 t70 -102.32 118.43 36.87 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.465 -0.772 . . . . 1.05 109.692 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -95.42 23.15 6.18 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.197 -0.939 . . . . 0.73 109.974 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.1 m -59.13 145.7 41.47 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.742 -1.224 . . . . 0.84 110.078 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.74 126.87 32.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 107.957 -1.127 . . . . 1.04 107.957 179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 t -68.08 -30.14 69.25 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.263 -1.014 . . . . 1.08 108.263 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.564 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 67.1 p-90 -76.44 -15.03 60.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.488 -0.757 . . . . 0.29 110.624 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.16 121.05 28.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.809 -1.182 . . . . 0.26 108.378 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.44 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -64.66 -53.62 33.83 Favored Glycine 0 N--CA 1.495 2.58 0 O-C-N 121.542 -0.724 . . . . 0.28 112.698 -177.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.44 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.5 Cg_endo -61.11 -29.92 88.16 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 CA-C-N 119.349 1.575 . . . . 0.5 112.279 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.22 17.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.155 -0.966 . . . . 1.04 109.442 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -59.75 -30.84 69.13 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.067 -1.021 . . . . 2.12 109.111 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' A' ' 37' ' ' MET . 13.8 tmm? -59.69 -28.4 67.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.643 -0.661 . . . . 2.66 109.498 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.6 mt -81.48 -4.13 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 O-C-N 121.545 -0.722 . . . . 1.22 111.179 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.21 -31.95 10.49 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 119.982 -1.699 . . . . 1.44 113.528 -177.063 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.9 Cg_exo -59.09 -39.84 75.99 Favored 'Trans proline' 0 N--CA 1.494 1.529 0 CA-C-N 121.387 1.531 . . . . 0.31 113.244 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -69.12 -49.22 59.03 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.504 -1.372 . . . . 0.45 108.849 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -59.99 -51.22 70.57 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.728 -0.842 . . . . 0.16 108.728 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 46.3 t60 -66.11 -44.14 85.16 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.897 -0.502 . . . . 0.35 110.985 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.5 m -63.24 -39.98 96.13 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.828 -1.17 . . . . 0.77 110.722 -179.322 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.02 -23.9 65.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.194 -0.941 . . . . 1.07 110.596 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -52.14 -40.19 61.01 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.84 -1.163 . . . . 0.87 108.602 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -84.66 -15.33 45.75 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.316 -0.865 . . . . 2.16 109.569 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -76.97 -38.08 53.95 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 107.502 -1.296 . . . . 2.29 107.502 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -121.64 68.0 0.91 Allowed 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 106.671 -1.603 . . . . 0.95 106.671 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 p -63.22 -9.88 13.18 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.384 -0.969 . . . . 0.89 108.384 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -90.23 9.75 27.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.129 -1.063 . . . . 1.13 108.129 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.3 t -127.85 143.94 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.861 -1.163 . . . . 1.06 107.861 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.6 mm -99.95 120.58 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 120.994 -1.066 . . . . 1.04 109.483 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 51.9 m-85 -103.3 126.06 50.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.181 -0.949 . . . . 0.13 109.816 179.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.477 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.2 mp -110.09 144.49 38.62 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.257 -0.902 . . . . 1.08 110.045 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -112.97 131.48 55.73 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.24 -1.393 . . . . 1.13 107.24 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.5 t -129.5 132.81 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.277 -0.89 . . . . 1.03 110.409 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.409 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 51.7 t0 -94.58 120.05 34.21 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.376 -0.827 . . . . 1.05 109.308 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.6 m -66.55 -18.17 23.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.478 -1.389 . . . . 1.04 108.156 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 16.1 m-20 -93.29 -44.79 8.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.441 -0.787 . . . . 1.08 112.264 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 78.9 m-20 -94.83 -13.61 25.38 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.554 -1.341 . . . . 1.07 108.91 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.4 37.88 4.31 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.542 -1.281 . . . . 1.03 107.542 179.086 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -60.12 -20.9 60.55 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.772 -0.58 . . . . 1.92 109.496 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.1 p30 -62.64 -36.96 84.51 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.929 -1.107 . . . . 1.05 108.473 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.524 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 21.4 t -73.31 -42.11 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.299 -0.876 . . . . 1.1 109.112 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.7 -41.43 79.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.392 -0.818 . . . . 1.03 111.083 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -59.99 -37.94 81.13 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.983 -1.073 . . . . 0.89 109.666 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -66.61 -37.93 85.92 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 2.06 109.507 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.56 -3.73 58.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.159 -0.963 . . . . 1.05 110.948 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 54.05 49.88 17.87 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.984 -1.073 . . . . 2.02 110.541 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.85 131.69 30.64 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.723 -1.236 . . . . 1.05 108.999 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -102.45 -10.73 19.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.572 -0.705 . . . . 2.16 110.655 -179.168 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.477 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.97 154.27 17.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.607 -1.308 . . . . 1.04 111.136 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 34.4 p -127.36 154.12 77.17 Favored Pre-proline 0 N--CA 1.502 2.147 0 N-CA-C 107.585 -1.265 . . . . 1.04 107.585 178.372 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -75.97 141.64 71.25 Favored 'Cis proline' 0 N--CA 1.497 1.718 0 C-N-CA 124.172 -1.179 . . . . 0.19 113.006 -1.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 91.5 m -126.98 132.29 50.84 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 121.657 0.742 . . . . 1.04 109.26 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.523 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.2 m-85 -109.0 130.24 55.47 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.779 -0.823 . . . . 0.23 108.779 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -122.16 140.35 52.67 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.615 -0.883 . . . . 0.43 108.615 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -107.9 134.86 50.22 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.398 0.618 . . . . 0.17 110.186 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -129.19 146.04 51.2 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.288 0.566 . . . . 0.17 109.56 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -145.46 134.89 23.13 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 107.283 -1.376 . . . . 2.18 107.283 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.8 mttt 50.06 33.36 6.81 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.923 -1.11 . . . . 1.8 109.014 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.98 25.68 74.22 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.58 -1.408 . . . . 0.23 109.58 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -129.14 132.78 47.4 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.465 -1.02 . . . . 2.75 110.989 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.1 122.89 26.8 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.083 -0.71 . . . . 2.3 109.083 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.0 m -123.35 8.33 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.698 . . . . 1.06 110.433 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.44 153.86 14.35 Favored Glycine 0 N--CA 1.495 2.578 0 C-N-CA 118.344 -1.884 . . . . 0.22 111.82 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -166.05 149.11 7.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 122.033 -0.686 . . . . 1.93 109.56 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.497 ' CB ' ' HZ3' ' A' ' 96' ' ' LYS . 19.9 p90 -163.66 163.66 24.22 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.279 -0.968 . . . . 0.16 109.339 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.91 160.34 31.3 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.504 0.669 . . . . 0.9 110.191 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.2 141.69 5.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.594 -1.402 . . . . 0.12 109.594 179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.27 65.41 2.85 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.288 -1.125 . . . . 1.04 109.347 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.55 93.95 4.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.587 -0.894 . . . . 1.36 108.587 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.47 74.65 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.273 -0.892 . . . . 1.6 111.494 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.84 -29.79 70.95 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.758 -1.214 . . . . 1.61 109.307 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.497 ' HZ3' ' CB ' ' A' ' 89' ' ' PHE . 56.5 tttm -61.11 -34.75 75.46 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.558 -0.714 . . . . 2.02 109.215 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 38.6 mt -58.92 -38.91 80.03 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.967 -1.123 . . . . 1.05 107.967 179.363 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -61.93 -42.54 99.21 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.906 -0.718 . . . . 2.1 110.966 -178.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.75 -43.8 75.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.003 -1.061 . . . . 1.06 111.717 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.4 m -65.65 -39.63 91.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.694 -1.254 . . . . 1.04 110.055 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -60.92 -49.15 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.921 -1.112 . . . . 1.04 108.73 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.6 t-20 -60.5 -35.52 76.13 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.151 -1.055 . . . . 1.09 108.151 179.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -67.45 -39.94 85.39 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 115.973 -0.558 . . . . 2.21 110.143 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.6 mt -99.23 -1.46 39.12 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.172 -0.955 . . . . 1.05 111.344 -178.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 4.9 p . . . . . 0 N--CA 1.498 1.97 0 O-C-N 120.49 -1.381 . . . . 1.08 109.426 -179.631 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo . . . . . 0 N--CA 1.493 1.454 0 CA-C-O 120.81 0.254 . . . . 1.75 112.687 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.48 125.78 38.27 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.87 -1.144 . . . . 1.35 109.279 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.414 ' O ' ' O ' ' B' ' 64' ' ' ILE . 51.3 m -107.11 129.86 54.77 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.467 -0.77 . . . . 1.36 108.962 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.97 -31.27 70.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 1.24 109.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -63.06 -19.97 64.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.508 -0.745 . . . . 1.89 109.459 -179.456 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.414 ' O ' ' O ' ' B' ' 61' ' ' THR . 33.6 mm -129.56 140.0 50.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.843 -0.535 . . . . 1.03 109.732 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -98.06 127.33 43.94 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 106.525 -1.658 . . . . 0.19 106.525 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.0 m -80.79 145.2 31.58 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.833 -1.167 . . . . 0.93 110.755 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.484 ' C ' ' H ' ' B' ' 69' ' ' VAL . 26.0 m95 -77.39 -9.94 59.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.133 -0.979 . . . . 0.21 108.815 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.95 -12.19 0.2 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.355 -0.841 . . . . 0.49 108.762 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.484 ' H ' ' C ' ' B' ' 67' ' ' TRP . 11.9 m -61.61 139.0 21.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 C-N-CA 119.226 -0.99 . . . . 1.66 109.181 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.25 -38.37 83.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.32 -0.863 . . . . 1.36 109.409 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 N-CA-C 109.398 -1.481 . . . . 2.32 109.398 -179.678 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.3 mmm . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.43 0.633 . . . . 3.32 109.664 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.3 t -98.79 133.02 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.454 -0.779 . . . . 1.16 109.956 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -129.92 129.47 43.91 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.345 -0.983 . . . . 2.18 108.345 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.532 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 65.4 tt0 -96.75 124.26 40.68 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.421 -0.799 . . . . 0.4 108.944 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.8 mm -102.65 117.1 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 108.505 -0.924 . . . . 1.04 108.505 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.532 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 64.4 mm-40 -99.72 -2.51 35.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.289 -0.882 . . . . 2.25 109.888 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -155.15 157.27 37.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.185 -0.947 . . . . 0.91 111.115 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.191 -1.04 . . . . 2.18 108.191 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.4 m -55.84 -48.4 75.57 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.354 -0.938 . . . . 1.03 109.191 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.72 -30.33 67.93 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.254 -0.904 . . . . 1.02 109.218 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.3 t80 -58.88 -44.26 91.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.326 -0.859 . . . . 0.15 109.38 -179.248 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -64.81 -42.31 95.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.308 -0.87 . . . . 2.07 109.151 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.534 ' OE1' ' N ' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.55 -39.58 94.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.753 -0.592 . . . . 1.77 110.451 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.99 -41.1 87.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.234 -0.917 . . . . 1.04 109.12 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 77.8 mt -60.58 -40.42 91.67 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 108.11 -1.07 . . . . 1.07 108.11 179.149 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -69.09 -35.99 77.09 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.353 0.597 . . . . 1.07 110.416 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.4 79.58 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.271 -0.893 . . . . 1.07 109.541 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.15 -34.6 73.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.363 -0.836 . . . . 1.03 109.799 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.21 -125.65 21.66 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 110.019 -1.232 . . . . 0.24 110.019 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -90.86 2.41 56.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.237 -1.155 . . . . 1.07 110.462 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -73.83 151.83 40.42 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.93 -1.106 . . . . 2.03 109.622 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.498 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.52 158.16 18.65 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 106.811 -1.552 . . . . 1.23 106.811 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.498 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 57.8 t -145.62 123.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.987 -1.07 . . . . 1.03 108.743 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -112.2 140.25 32.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 108.483 -0.932 . . . . 1.03 108.483 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.7 t -123.44 119.99 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.358 -0.838 . . . . 1.01 109.499 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -97.42 119.75 36.54 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.306 -0.871 . . . . 1.05 110.038 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -96.52 25.26 5.21 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.955 -1.091 . . . . 0.73 110.175 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.4 m -59.89 147.33 38.91 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 120.954 -1.091 . . . . 0.84 110.773 -178.604 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.48 126.53 32.87 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.772 -1.196 . . . . 1.04 107.772 179.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.5 -33.97 76.19 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.024 -1.102 . . . . 1.08 108.024 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.525 ' CD1' ' OD1' ' A' ' 60' ' ' ASP . 59.7 p-90 -71.35 -26.63 62.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.447 -0.783 . . . . 0.29 110.686 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.6 t -80.7 112.9 18.51 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.834 -1.172 . . . . 0.26 107.834 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.463 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.36 -51.22 60.09 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 111.274 -0.73 . . . . 0.28 111.274 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -49.84 -37.87 46.41 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.754 1.277 . . . . 0.5 111.318 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.37 -46.98 29.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.191 -0.943 . . . . 1.04 108.913 178.953 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -59.74 -30.15 68.64 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.626 -0.879 . . . . 2.12 108.626 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 12.4 tpt -59.67 -30.19 68.58 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.601 -0.687 . . . . 2.66 110.14 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.3 mt -83.58 -4.79 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.695 -0.628 . . . . 1.22 110.756 -178.571 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.548 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.54 -31.94 10.21 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.803 -1.81 . . . . 1.44 113.236 -176.836 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -57.91 -38.96 90.35 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 CA-C-N 121.487 1.567 . . . . 0.31 111.914 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -71.79 -51.23 23.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.146 -0.971 . . . . 0.45 108.985 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.44 -48.04 82.01 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.16 -0.962 . . . . 0.16 108.613 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -68.62 -41.24 79.77 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.567 -0.708 . . . . 0.35 110.746 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 58.7 m -63.82 -37.21 86.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.997 -1.064 . . . . 0.77 109.952 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.1 mt -62.29 -27.82 69.29 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.108 -0.995 . . . . 1.07 110.649 -178.649 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.2 m -51.73 -38.02 53.5 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 120.873 -1.142 . . . . 0.87 109.03 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -87.02 -15.7 37.88 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.12 -0.987 . . . . 2.16 109.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -79.02 -37.94 37.82 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.625 -1.297 . . . . 2.29 107.709 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -120.32 65.93 0.83 Allowed 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 106.857 -1.534 . . . . 0.95 106.857 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.4 p -62.93 -8.11 6.51 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 108.625 -0.88 . . . . 0.89 108.625 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -91.02 4.44 52.08 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.957 -0.757 . . . . 1.13 108.957 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.0 t -124.29 147.84 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.078 -1.453 . . . . 1.06 107.078 178.977 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.17 123.5 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 120.956 -1.09 . . . . 1.04 109.248 -178.42 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -103.94 126.87 51.38 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.35 -0.844 . . . . 0.13 110.039 179.367 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.459 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.4 mp -111.98 141.76 45.23 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 121.281 -0.887 . . . . 1.08 109.518 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -111.82 132.27 54.79 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 107.313 -1.366 . . . . 1.13 107.313 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.88 135.68 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.268 -0.895 . . . . 1.03 110.486 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 45.3 t0 -98.48 120.61 39.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.444 -0.785 . . . . 1.05 109.121 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.21 -19.6 25.92 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 O-C-N 120.643 -1.286 . . . . 1.04 108.404 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.525 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.0 m-20 -93.05 -41.65 9.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.521 -0.737 . . . . 1.08 111.812 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -95.54 -16.66 22.01 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.645 -1.284 . . . . 1.07 108.659 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.71 39.06 4.05 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.777 -1.194 . . . . 1.03 107.777 179.615 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.11 -19.99 56.07 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.753 -0.592 . . . . 1.92 109.938 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -65.03 -36.55 84.74 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.073 -1.017 . . . . 1.05 108.877 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.539 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -72.73 -42.44 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 108.409 -0.96 . . . . 1.1 108.409 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.04 -40.66 82.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.608 -0.683 . . . . 1.03 110.568 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.6 p -60.23 -40.29 89.71 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.761 -1.175 . . . . 0.89 109.577 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -66.2 -39.38 89.61 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 2.06 109.175 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.52 -4.68 59.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.152 -0.968 . . . . 1.05 110.739 -179.344 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 53.77 49.98 18.01 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.852 -1.155 . . . . 2.02 109.887 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.6 t -65.01 130.46 30.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 C-N-CA 118.425 -1.31 . . . . 1.05 108.375 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -103.05 -11.07 18.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.576 -0.702 . . . . 2.16 110.694 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.495 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.25 155.81 23.2 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.599 -1.313 . . . . 1.04 110.605 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.1 p -129.44 153.63 80.63 Favored Pre-proline 0 N--CA 1.501 2.1 0 N-CA-C 108.148 -1.056 . . . . 1.04 108.148 178.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -76.59 143.33 75.75 Favored 'Cis proline' 0 N--CA 1.489 1.259 0 C-N-CA 123.613 -1.411 . . . . 0.19 112.667 -2.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.3 m -127.85 135.0 49.44 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.23 -1.026 . . . . 1.04 108.23 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -113.32 131.84 55.8 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.966 -0.753 . . . . 0.23 108.966 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.6 mt-30 -120.44 141.86 49.76 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.283 -1.006 . . . . 0.43 108.283 179.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -108.03 134.8 50.42 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.472 0.653 . . . . 0.17 110.226 -179.23 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -128.64 147.11 50.71 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 109.176 -0.675 . . . . 0.17 109.176 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -149.62 125.29 10.39 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.788 -1.19 . . . . 2.18 107.788 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 59.74 30.2 19.78 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 107.787 -1.19 . . . . 1.8 107.787 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.1 14.91 81.8 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.713 -1.355 . . . . 0.23 109.713 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.42 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 4.4 mm-40 -116.89 135.64 53.56 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.546 -0.973 . . . . 2.75 110.91 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -78.98 123.88 27.72 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.695 -0.854 . . . . 2.3 108.695 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.2 m -123.8 7.61 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.472 -0.768 . . . . 1.06 111.439 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.95 156.13 17.22 Favored Glycine 0 N--CA 1.498 2.819 0 C-N-CA 118.426 -1.845 . . . . 0.22 111.513 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -164.71 149.17 9.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.872 -0.781 . . . . 1.93 109.353 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.447 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 7.0 p90 -163.86 159.44 21.09 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.635 -0.826 . . . . 0.16 109.78 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.6 p -127.37 160.65 30.76 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.595 0.712 . . . . 0.9 109.924 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.22 140.6 5.7 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.17 -1.572 . . . . 0.12 109.17 179.431 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.28 67.27 2.5 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.219 -1.165 . . . . 1.04 109.146 179.785 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.37 95.09 4.59 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.548 -0.908 . . . . 1.36 108.548 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -34.76 77.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.141 -0.975 . . . . 1.6 111.403 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.97 -28.71 70.27 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.077 -1.015 . . . . 1.61 109.412 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.84 -34.64 76.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.331 -0.856 . . . . 2.02 108.836 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.46 -38.69 81.44 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.218 -1.03 . . . . 1.05 108.218 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -63.16 -43.4 98.41 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 119.845 -0.742 . . . . 2.1 110.46 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -44.0 77.33 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 1.06 111.143 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.9 m -65.37 -39.67 92.6 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.973 -1.079 . . . . 1.04 110.706 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.01 -48.36 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.067 -1.02 . . . . 1.04 108.267 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -60.5 -34.75 74.52 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.194 -1.039 . . . . 1.09 108.194 178.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.9 tt0 -67.93 -39.89 83.44 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.548 -0.72 . . . . 2.21 110.63 -178.488 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 86.2 mt -100.68 0.28 38.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.226 -0.922 . . . . 1.05 111.273 -178.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 N--CA 1.497 1.905 0 O-C-N 120.569 -1.332 . . . . 1.08 108.992 -179.517 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 N--CA 1.495 1.572 0 CA-C-O 121.169 0.404 . . . . 1.75 112.291 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -98.12 121.36 39.95 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.185 -0.947 . . . . 1.35 109.401 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.439 ' O ' ' O ' ' B' ' 64' ' ' ILE . 25.2 m -107.51 131.85 53.88 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.441 -0.787 . . . . 1.36 109.543 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 55.5 mt -64.49 -31.47 72.7 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.218 -0.926 . . . . 1.24 109.473 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp -64.69 -16.54 63.02 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.847 -0.797 . . . . 1.89 108.847 -179.853 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.439 ' O ' ' O ' ' B' ' 61' ' ' THR . 29.7 mm -126.34 139.97 50.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 109.372 -0.603 . . . . 1.03 109.372 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 5.0 m -96.45 127.98 42.96 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 106.54 -1.652 . . . . 0.19 106.54 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.3 m -78.89 144.25 35.09 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.852 -1.155 . . . . 0.93 110.554 -178.204 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.439 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.8 m95 -79.62 -14.62 58.68 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.21 109.056 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.0 m120 -57.42 -11.66 2.05 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.788 -1.19 . . . . 0.49 107.788 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.439 ' H ' ' C ' ' B' ' 67' ' ' TRP . 7.7 p -64.12 136.93 25.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 O-C-N 121.682 -0.636 . . . . 1.66 109.322 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -60.46 -38.42 84.14 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 1.36 108.622 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.337 0 CA-C-O 117.93 -1.483 . . . . 2.32 109.695 179.994 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.307 0.575 . . . . 3.32 109.546 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 61.5 t -98.96 159.53 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 1.16 109.539 -179.661 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -129.96 130.02 44.52 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.782 -0.821 . . . . 2.18 108.782 -179.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -97.01 124.03 40.88 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.867 -0.79 . . . . 0.4 108.867 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.2 mm -102.15 115.83 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 108.17 -1.048 . . . . 1.04 108.17 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -99.68 0.14 41.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.333 -0.854 . . . . 2.25 109.619 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.2 155.15 37.21 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.146 -0.971 . . . . 0.91 110.929 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.534 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 4.3 ttpm? -65.26 -32.85 74.72 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.765 -1.198 . . . . 2.18 107.765 177.916 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.444 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 46.5 m -58.71 -46.98 86.12 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.215 -1.031 . . . . 1.03 108.215 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.24 -31.76 70.53 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.37 -0.831 . . . . 1.02 108.837 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.2 t80 -59.81 -43.71 94.37 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.15 109.15 -179.793 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -64.45 -44.01 92.47 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.584 -0.847 . . . . 2.07 108.796 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.44 -41.1 98.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.565 -0.709 . . . . 1.77 110.723 179.301 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.76 -42.17 95.34 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.252 -0.905 . . . . 1.04 109.285 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 87.1 mt -59.85 -39.86 86.62 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.089 -1.007 . . . . 1.07 108.418 179.156 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.41 -34.67 74.81 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.592 -0.693 . . . . 1.07 110.476 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.02 80.9 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 1.07 110.591 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.21 -30.97 69.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.127 -0.983 . . . . 1.03 110.067 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.95 -125.7 25.42 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.171 -1.172 . . . . 0.24 110.171 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -90.7 3.49 54.1 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -1.143 . . . . 1.07 109.964 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -75.63 148.55 38.67 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 2.03 109.892 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.502 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.54 157.78 16.51 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.667 -1.234 . . . . 1.23 107.667 179.306 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.502 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 46.9 t -147.01 118.07 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 120.903 -1.123 . . . . 1.03 108.884 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 139.48 27.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.378 -0.971 . . . . 1.03 108.378 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.5 t -123.02 122.62 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.135 -0.978 . . . . 1.01 110.081 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -98.21 119.7 37.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.441 -0.787 . . . . 1.05 109.919 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -96.38 24.46 5.79 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.068 -1.02 . . . . 0.73 109.886 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.7 m -58.64 146.94 34.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.84 110.077 -179.017 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.55 122.92 30.37 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.926 -1.139 . . . . 1.04 107.926 179.117 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 t -67.28 -30.26 70.08 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 118.962 -1.095 . . . . 1.08 108.088 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.564 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 52.1 p-90 -71.45 -27.0 62.96 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.441 -0.787 . . . . 0.29 110.885 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.6 t -83.79 120.49 26.1 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.109 -1.071 . . . . 0.26 108.109 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -62.37 -52.1 51.69 Favored Glycine 0 N--CA 1.489 2.2 0 C-N-CA 119.846 -1.169 . . . . 0.28 111.042 -178.516 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.4 Cg_exo -52.15 -34.58 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.702 1.251 . . . . 0.5 112.59 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.96 -53.77 7.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.91 . . . . 1.04 110.276 -179.358 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -60.0 -37.37 79.48 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.803 -1.185 . . . . 2.12 109.701 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.525 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.0 tmm? -58.46 -27.98 64.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.148 -0.97 . . . . 2.66 109.342 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.4 mt -87.01 -12.07 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.599 -0.688 . . . . 1.22 112.051 -179.193 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 29.6 pttt -67.44 -30.53 3.03 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 120.062 -1.649 . . . . 1.44 113.511 -177.504 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.8 Cg_exo -49.79 -36.78 43.43 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 121.803 1.68 . . . . 0.31 112.215 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -67.79 -44.13 78.09 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.384 -1.71 . . . . 0.45 106.384 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.35 -52.45 65.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.946 . . . . 0.16 110.101 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -67.62 -40.11 84.68 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.49 -0.757 . . . . 0.35 109.928 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 70.3 m -61.17 -39.58 90.7 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.381 -0.824 . . . . 0.77 110.567 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.2 mt -62.36 -19.58 63.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.45 -0.781 . . . . 1.07 110.707 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -55.4 -37.12 67.18 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.593 -1.317 . . . . 0.87 108.471 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -82.73 -19.8 37.22 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.509 -0.744 . . . . 2.16 109.103 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -76.62 -37.36 56.5 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.91 -1.144 . . . . 2.29 107.91 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -123.69 67.12 1.02 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.136 -1.431 . . . . 0.95 107.136 177.879 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 80.2 p -63.44 -10.05 15.47 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.42 0.629 . . . . 0.89 109.573 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -91.02 10.43 26.69 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.215 -1.031 . . . . 1.13 108.215 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 48.2 t -128.52 148.21 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 108.353 -0.98 . . . . 1.06 108.353 179.617 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.423 HD11 HG22 ' A' ' 53' ' ' ILE . 30.0 mm -98.79 123.95 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.129 -0.982 . . . . 1.04 109.688 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -108.43 123.86 49.52 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.354 -0.841 . . . . 0.13 109.246 179.754 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.428 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.9 mp -110.26 144.81 38.41 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 120.906 -1.121 . . . . 1.08 110.136 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -112.54 129.73 56.26 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 106.577 -1.638 . . . . 1.13 106.577 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.4 t -126.46 135.54 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.19 -0.944 . . . . 1.03 110.63 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.433 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 58.2 t0 -94.47 119.66 33.51 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.738 -0.838 . . . . 1.05 108.738 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.2 m -69.16 -18.52 22.85 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 C-N-CA 118.638 -1.225 . . . . 1.04 108.453 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.8 m-20 -93.01 -42.68 9.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.45 -0.781 . . . . 1.08 111.343 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.433 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 81.3 m-20 -93.92 -15.26 25.13 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.623 -1.298 . . . . 1.07 108.098 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -122.4 38.39 4.16 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 107.684 -1.228 . . . . 1.03 107.684 179.177 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.8 pt20 -59.56 -22.63 61.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 1.92 109.8 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.534 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 4.8 p-10 -66.07 -42.9 88.81 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.104 -0.997 . . . . 1.05 108.766 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.2 t -68.72 -44.01 82.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 O-C-N 121.328 -0.858 . . . . 1.1 109.88 179.989 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.81 72.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.215 -0.928 . . . . 1.03 110.324 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.8 p -61.6 -31.66 71.74 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.045 -1.034 . . . . 0.89 108.711 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -63.81 -40.16 95.97 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.445 -0.785 . . . . 2.06 109.398 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.69 1.39 55.19 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.461 -0.774 . . . . 1.05 110.923 -179.182 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 54.49 50.83 15.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.991 -1.068 . . . . 2.02 109.246 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.1 t -64.35 129.16 27.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 C-N-CA 118.261 -1.376 . . . . 1.05 107.939 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -101.71 -12.71 18.16 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.65 -0.656 . . . . 2.16 109.904 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.47 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.58 156.93 21.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.98 -1.075 . . . . 1.04 110.7 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -129.38 154.62 80.71 Favored Pre-proline 0 N--CA 1.501 2.103 0 N-CA-C 108.184 -1.043 . . . . 1.04 108.184 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -75.0 142.02 73.51 Favored 'Cis proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.841 -1.316 . . . . 0.19 113.439 -1.562 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -126.31 132.19 51.68 Favored 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.521 -0.918 . . . . 1.04 108.521 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 91.5 m-85 -111.39 127.15 55.57 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.401 -0.962 . . . . 0.23 108.401 -178.935 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.6 mt-30 -119.5 141.48 49.15 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.149 -0.969 . . . . 0.43 108.898 179.801 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.405 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 70.8 m-85 -107.8 132.21 53.64 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.198 0.523 . . . . 0.17 110.177 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -125.63 146.3 49.77 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.553 0.692 . . . . 0.17 109.499 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -146.69 129.78 16.46 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.622 -1.251 . . . . 2.18 107.622 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 53.34 31.99 12.89 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.108 -0.995 . . . . 1.8 109.76 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.36 19.78 77.83 Favored Glycine 0 N--CA 1.491 2.321 0 O-C-N 120.954 -1.091 . . . . 0.23 110.879 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -128.77 139.79 52.03 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.311 -1.111 . . . . 2.75 110.378 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -81.3 127.83 33.16 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.196 -0.94 . . . . 2.3 109.506 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.2 m -123.94 9.74 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.608 -0.683 . . . . 1.06 110.283 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.97 151.14 9.68 Favored Glycine 0 N--CA 1.5 2.952 0 C-N-CA 118.719 -1.705 . . . . 0.22 111.713 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -166.06 148.92 7.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.621 -0.929 . . . . 1.93 109.806 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -163.72 162.93 24.25 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.598 -0.841 . . . . 0.16 108.81 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.7 p -126.74 159.92 32.34 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.351 -0.611 . . . . 0.9 109.351 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.4 143.37 6.16 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.834 -1.306 . . . . 0.12 109.834 178.841 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.58 65.12 2.34 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.15 -1.206 . . . . 1.04 110.098 179.996 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.484 ' ND2' ' OE1' ' A' ' 95' ' ' GLU . 0.7 OUTLIER -119.46 94.0 4.27 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 107.936 -1.135 . . . . 1.36 107.936 178.334 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -33.15 73.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.079 -1.013 . . . . 1.6 111.303 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.484 ' OE1' ' ND2' ' A' ' 93' ' ' ASN . 35.1 mp0 -63.41 -30.18 71.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.943 -1.098 . . . . 1.61 109.291 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -60.73 -33.68 73.27 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.167 -0.679 . . . . 2.02 109.167 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 35.8 mt -59.76 -38.95 83.22 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.566 -0.902 . . . . 1.05 108.566 179.57 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -62.67 -40.93 98.62 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.095 -0.642 . . . . 2.1 110.992 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.39 -44.1 72.15 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.246 -0.909 . . . . 1.06 112.027 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.55 -38.62 91.64 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.724 -1.235 . . . . 1.04 110.025 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.13 -48.91 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 108.162 -1.051 . . . . 1.04 108.162 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.1 t-20 -61.0 -34.12 74.32 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.561 -0.903 . . . . 1.09 108.561 178.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -68.85 -39.86 79.7 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.485 -0.759 . . . . 2.21 110.186 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.4 mt -100.72 1.45 40.45 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.376 -0.828 . . . . 1.05 111.345 -178.424 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.8 p . . . . . 0 N--CA 1.499 2.002 0 O-C-N 120.475 -1.391 . . . . 1.08 109.064 179.955 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 N--CA 1.493 1.466 0 CA-C-O 121.595 0.581 . . . . 1.75 110.785 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.33 119.89 27.09 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.012 -0.736 . . . . 1.35 109.012 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.42 ' O ' ' O ' ' B' ' 64' ' ' ILE . 23.2 m -111.15 131.43 55.1 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.256 -0.646 . . . . 1.36 109.256 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 90.3 mt -67.53 -30.4 70.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.076 -1.015 . . . . 1.24 109.124 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt -64.55 -19.86 65.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.606 -0.684 . . . . 1.89 109.953 -179.445 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.42 ' O ' ' O ' ' B' ' 61' ' ' THR . 29.1 mm -131.94 140.71 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 N-CA-C 109.716 -0.476 . . . . 1.03 109.716 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 56.4 m -98.63 131.68 44.63 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.817 -1.549 . . . . 0.19 106.817 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -81.18 144.85 31.33 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.629 -1.294 . . . . 0.93 111.372 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.452 ' C ' ' H ' ' B' ' 69' ' ' VAL . 24.2 m95 -79.62 -13.86 59.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.21 109.106 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -58.5 -11.32 2.82 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.363 -1.347 . . . . 0.49 107.363 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.452 ' H ' ' C ' ' B' ' 67' ' ' TRP . 7.1 p -68.27 144.13 14.6 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 108.875 -0.787 . . . . 1.66 108.875 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -60.1 -39.96 87.97 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.176 -0.952 . . . . 1.36 109.315 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . 0.443 ' H ' HG23 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.007 -1.441 . . . . 2.32 109.643 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 108.718 -0.845 . . . . 3.32 108.718 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.409 ' CG1' ' N ' ' A' ' 3' ' ' LYS . 68.8 t -100.88 158.82 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.459 -0.776 . . . . 1.16 109.323 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.409 ' N ' ' CG1' ' A' ' 2' ' ' VAL . 21.6 tptp -129.98 126.33 37.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.352 -0.843 . . . . 2.18 108.77 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -93.84 121.92 35.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.14 -0.975 . . . . 0.4 109.316 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.3 mm -101.51 117.53 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.492 -0.929 . . . . 1.04 108.492 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -99.1 -1.75 38.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.377 -0.827 . . . . 2.25 109.515 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.26 155.33 36.38 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.825 -1.172 . . . . 0.91 111.542 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.489 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 34.4 ttmt -63.61 -32.87 74.47 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.94 -1.133 . . . . 2.18 107.94 177.982 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 80.5 m -58.71 -45.89 88.57 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.153 -1.019 . . . . 1.03 108.316 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.86 -31.82 69.86 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.304 -0.873 . . . . 1.02 108.86 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 48.5 t80 -59.14 -43.94 92.04 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.007 . . . . 0.15 108.691 179.984 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -64.62 -42.67 95.34 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.623 -0.88 . . . . 2.07 108.623 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.08 -36.85 85.37 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.67 -0.644 . . . . 1.77 109.963 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.13 -42.81 79.63 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.071 -1.018 . . . . 1.04 109.339 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.52 -39.36 87.56 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.124 -1.065 . . . . 1.07 108.124 179.49 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.61 -34.37 73.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.466 -0.771 . . . . 1.07 109.892 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.68 -37.8 70.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.21 -0.931 . . . . 1.07 110.3 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -32.44 73.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.254 -0.904 . . . . 1.03 109.309 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.63 -124.76 21.95 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.983 -1.247 . . . . 0.24 109.983 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -91.41 4.74 51.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.397 -1.061 . . . . 1.07 110.271 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -76.54 149.3 36.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.154 -0.966 . . . . 2.03 109.096 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.448 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.86 156.68 16.76 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.503 -1.295 . . . . 1.23 107.503 179.631 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.448 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 97.8 t -143.09 113.15 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.932 -1.105 . . . . 1.03 108.676 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.1 t -100.02 139.79 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.443 -0.947 . . . . 1.03 108.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.2 t -124.03 122.09 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.416 -0.803 . . . . 1.01 110.832 -178.827 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.528 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.7 t70 -98.44 120.24 38.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.631 -0.668 . . . . 1.05 110.305 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.53 25.74 4.89 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.96 -1.088 . . . . 0.73 109.756 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.0 m -59.43 143.25 50.35 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 120.878 -1.139 . . . . 0.84 110.453 -178.68 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.14 127.96 33.66 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 106.979 -1.489 . . . . 1.04 106.979 178.727 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -67.35 -32.25 73.06 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 118.894 -1.122 . . . . 1.08 108.318 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.504 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 61.3 p-90 -73.06 -19.8 61.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.023 -1.048 . . . . 0.29 110.657 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.2 t -85.24 116.73 23.76 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.736 -1.228 . . . . 0.26 107.867 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.451 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.57 -51.78 55.4 Favored Glycine 0 N--CA 1.496 2.662 0 O-C-N 121.659 -0.65 . . . . 0.28 111.978 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.1 Cg_exo -52.83 -36.09 72.56 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 CA-C-N 118.464 1.132 . . . . 0.5 111.907 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.52 -52.57 9.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.516 -0.74 . . . . 1.04 110.301 -179.823 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -59.94 -36.59 77.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.129 -0.982 . . . . 2.12 109.332 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.506 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.9 tmm? -59.9 -29.3 68.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.501 -0.749 . . . . 2.66 109.549 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.459 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 78.5 mt -79.44 -2.26 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.913 -0.492 . . . . 1.22 110.488 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.39 6.25 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 120.591 -1.318 . . . . 1.44 114.049 -177.891 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -57.24 -39.8 87.37 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 CA-C-N 121.842 1.693 . . . . 0.31 113.022 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -69.56 -48.52 60.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.262 -1.524 . . . . 0.45 108.651 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.06 -51.77 68.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.351 -0.843 . . . . 0.16 109.745 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -67.35 -40.94 85.87 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.589 -0.694 . . . . 0.35 110.385 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.481 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -61.31 -38.64 87.58 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.695 -1.253 . . . . 0.77 110.737 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.72 -21.52 66.44 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 1.07 110.701 -178.159 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -55.67 -35.62 66.2 Favored 'General case' 0 C--N 1.296 -1.721 0 O-C-N 120.894 -1.129 . . . . 0.87 108.277 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -85.97 -19.54 30.27 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.893 . . . . 2.16 109.897 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.24 -37.65 57.38 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 107.468 -1.308 . . . . 2.29 107.468 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.15 67.58 0.99 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.078 -1.453 . . . . 0.95 107.078 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.79 -8.27 10.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.037 -0.727 . . . . 0.89 109.037 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -90.67 10.2 26.73 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.115 -1.068 . . . . 1.13 108.115 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.5 t -129.56 142.08 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 107.696 -1.224 . . . . 1.06 107.696 179.037 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.442 HG22 HD11 ' A' ' 53' ' ' ILE . 26.8 mm -97.92 121.87 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.092 -1.005 . . . . 1.04 109.588 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 43.5 m-85 -101.62 124.15 46.8 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.364 -0.835 . . . . 0.13 109.159 179.756 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 2.3 mp -109.81 146.17 35.49 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.759 -1.213 . . . . 1.08 109.382 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.8 129.21 56.51 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 106.98 -1.489 . . . . 1.13 106.98 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.0 t -124.91 132.32 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.503 0.668 . . . . 1.03 110.377 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.6 t0 -95.68 118.7 32.84 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.531 -0.914 . . . . 1.05 108.531 179.493 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -65.59 -18.76 24.47 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 O-C-N 120.121 -1.612 . . . . 1.04 107.862 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.504 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.45 -40.85 10.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.631 . . . . 1.08 112.23 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 46.1 m-20 -95.61 -20.89 18.6 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.249 -1.532 . . . . 1.07 108.632 179.367 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.69 41.02 3.38 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.732 -1.21 . . . . 1.03 107.732 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -60.03 -20.66 59.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.579 -0.701 . . . . 1.92 110.097 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.53 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -62.77 -38.03 89.0 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 120.874 -1.141 . . . . 1.05 109.445 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.53 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 21.3 t -75.18 -44.46 43.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.013 -1.054 . . . . 1.1 109.825 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.34 -39.1 78.35 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.552 -0.859 . . . . 1.03 110.206 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -60.79 -36.48 79.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.007 -1.058 . . . . 0.89 108.539 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.489 ' OE2' ' NZ ' ' A' ' 8' ' ' LYS . 42.0 tt0 -63.09 -39.02 93.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 2.06 109.408 179.151 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.39 -0.06 55.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 1.05 110.697 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 53.09 50.2 18.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.966 -1.084 . . . . 2.02 109.728 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -66.55 132.38 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.859 -1.151 . . . . 1.05 109.35 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -103.19 -8.37 20.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.578 -0.701 . . . . 2.16 110.767 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.46 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.62 156.16 17.95 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.573 -1.33 . . . . 1.04 111.191 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.43 153.76 80.64 Favored Pre-proline 0 N--CA 1.502 2.148 0 N-CA-C 107.274 -1.38 . . . . 1.04 107.274 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -75.81 143.74 77.85 Favored 'Cis proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.848 -1.313 . . . . 0.19 112.788 -2.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.45 ' CG2' ' OE2' ' A' ' 88' ' ' GLU . 98.3 m -129.13 134.31 48.0 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.808 0.813 . . . . 1.04 108.953 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.528 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.4 m-85 -110.44 129.43 55.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 109.329 -0.619 . . . . 0.23 109.329 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -122.53 141.24 51.88 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.451 -0.944 . . . . 0.43 108.451 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -108.27 132.07 54.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.673 -0.642 . . . . 0.17 110.399 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -125.41 145.67 49.95 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.337 -0.616 . . . . 0.17 109.337 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -145.92 127.47 15.1 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.305 -1.368 . . . . 2.18 107.305 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 58.35 23.19 10.23 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.121 -1.066 . . . . 1.8 108.121 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 82.02 15.88 73.74 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 110.105 -1.198 . . . . 0.23 110.105 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.5 mm-40 -116.2 138.01 51.64 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.519 -0.989 . . . . 2.75 109.891 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -81.28 121.5 26.25 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.012 -1.107 . . . . 2.3 108.012 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.2 m -121.28 13.3 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.572 -0.705 . . . . 1.06 110.254 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -180.0 156.93 19.2 Favored Glycine 0 N--CA 1.496 2.637 0 C-N-CA 118.897 -1.621 . . . . 0.22 111.071 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.471 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 2.2 tp10 -166.84 147.73 5.91 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.65 -0.912 . . . . 1.93 108.727 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.456 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 11.0 p90 -166.98 162.58 15.69 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.199 -1.0 . . . . 0.16 108.945 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -128.88 169.61 14.4 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.621 0.724 . . . . 0.9 109.821 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 113.39 141.96 8.12 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.198 -1.561 . . . . 0.12 109.198 179.394 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.01 66.46 5.5 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.35 -1.088 . . . . 1.04 109.779 179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -119.05 100.06 7.11 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.853 -1.166 . . . . 1.36 107.853 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.99 -33.37 73.57 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.352 -0.842 . . . . 1.6 111.924 -178.751 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -64.6 -29.49 70.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.802 -1.186 . . . . 1.61 110.051 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.413 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 55.2 tttp -61.9 -34.87 76.84 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.699 -0.852 . . . . 2.02 108.699 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.4 mt -59.48 -40.02 85.63 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 122.279 1.038 . . . . 1.05 108.484 179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -62.61 -42.51 99.62 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.545 -0.752 . . . . 2.1 110.981 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.75 77.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.101 -0.999 . . . . 1.06 111.288 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -64.76 -39.59 93.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.773 -1.205 . . . . 1.04 110.129 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.413 ' O ' ' N ' ' A' ' 105' ' ' VAL . 65.4 mt -61.55 -49.41 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 1.04 108.509 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.6 t-20 -60.26 -35.55 75.77 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.046 0.927 . . . . 1.09 108.613 178.896 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -67.32 -40.13 85.92 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.66 -0.65 . . . . 2.21 109.654 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 95.2 mt -98.74 -3.94 34.61 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.545 -0.722 . . . . 1.05 111.458 -178.594 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.413 ' N ' ' O ' ' A' ' 101' ' ' ILE . 6.0 p . . . . . 0 N--CA 1.497 1.897 0 O-C-N 120.392 -1.443 . . . . 1.08 108.807 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo . . . . . 0 N--CA 1.493 1.496 0 CA-C-O 121.393 0.497 . . . . 1.75 112.35 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -92.17 125.15 36.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.253 -0.905 . . . . 1.35 109.366 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.405 HG21 ' H ' ' B' ' 63' ' ' LYS . 22.3 m -103.04 130.03 50.03 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.431 -0.793 . . . . 1.36 109.502 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.76 -27.45 67.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.417 -0.802 . . . . 1.24 109.703 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.405 ' H ' HG21 ' B' ' 61' ' ' THR . 29.8 mmtp -61.52 -18.28 58.45 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.243 -0.911 . . . . 1.89 109.711 -179.606 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 30.4 mm -128.8 140.42 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.914 -0.491 . . . . 1.03 110.304 -179.635 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -95.66 129.76 42.76 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.224 -1.399 . . . . 0.19 107.224 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.6 m -78.52 140.58 38.54 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.757 -1.214 . . . . 0.93 111.049 -178.886 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.46 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.0 m95 -76.12 -8.44 57.01 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.699 -1.25 . . . . 0.21 108.975 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -53.79 -11.95 0.47 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.124 -0.985 . . . . 0.49 108.739 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.451 ' H ' ' C ' ' B' ' 67' ' ' TRP . 16.8 m -61.85 143.57 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 1.66 109.602 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.27 -38.18 85.81 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.238 -0.914 . . . . 1.36 108.932 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.387 -1.485 . . . . 2.32 109.387 -179.879 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.5 mmm . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.34 0.591 . . . . 3.32 109.758 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.3 t -99.47 132.17 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.508 -0.745 . . . . 1.16 109.234 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -132.29 133.54 44.19 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.208 -0.933 . . . . 2.18 108.848 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -97.79 124.11 42.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.383 -0.823 . . . . 0.4 109.288 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.28 115.85 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.349 -0.845 . . . . 1.04 108.788 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -99.67 -0.89 39.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.265 -0.897 . . . . 2.25 108.978 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -151.68 153.88 35.25 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.046 . . . . 0.91 111.04 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -64.3 -31.55 72.8 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.254 -1.017 . . . . 2.18 108.254 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.5 m -58.15 -47.21 84.07 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.382 -0.927 . . . . 1.03 108.601 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.12 -30.9 70.15 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.515 -0.74 . . . . 1.02 109.107 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.8 t80 -59.35 -44.05 92.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.252 -0.905 . . . . 0.15 108.977 -179.321 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -65.41 -41.85 93.17 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.404 -0.961 . . . . 2.07 108.404 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.37 -37.49 87.7 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.664 -0.648 . . . . 1.77 110.299 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.12 79.14 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.277 -0.89 . . . . 1.04 109.586 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 88.3 mt -60.15 -40.63 90.52 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.166 -0.959 . . . . 1.07 108.537 -179.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -68.48 -37.08 79.82 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.654 -0.653 . . . . 1.07 110.243 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.06 -36.65 80.21 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.44 -0.787 . . . . 1.07 110.406 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.31 -33.11 74.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.041 -1.037 . . . . 1.03 109.294 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.19 20.18 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.268 -1.133 . . . . 0.24 110.268 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.474 ' CG ' ' HZ2' ' A' ' 82' ' ' LYS . 71.0 m-20 -89.92 0.53 57.02 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.263 -1.139 . . . . 1.07 110.457 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -73.98 147.59 42.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.825 -1.172 . . . . 2.03 109.401 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.502 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.21 159.73 7.25 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.118 -1.438 . . . . 1.23 107.118 179.79 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.502 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 96.0 t -146.41 121.27 2.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 O-C-N 120.812 -1.18 . . . . 1.03 108.605 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.6 t -109.59 140.0 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.305 -0.998 . . . . 1.03 108.305 179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.59 121.27 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.329 -0.857 . . . . 1.01 109.557 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.2 t70 -98.41 117.61 33.21 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.457 -0.777 . . . . 1.05 109.756 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -94.48 25.72 3.78 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.142 -0.974 . . . . 0.73 110.02 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.414 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 53.2 m -59.31 146.62 38.92 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 121.102 -0.999 . . . . 0.84 110.616 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.42 126.82 32.64 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.785 -1.191 . . . . 1.04 107.785 179.103 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.13 -31.61 71.31 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.938 -1.105 . . . . 1.08 108.909 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.529 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 56.1 p-90 -74.1 -22.4 59.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.427 -0.795 . . . . 0.29 111.04 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -83.39 110.44 18.15 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.74 -1.207 . . . . 0.26 107.74 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.474 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.86 -50.35 68.49 Favored Glycine 0 N--CA 1.485 1.907 0 C-N-CA 120.258 -0.972 . . . . 0.28 110.772 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.5 Cg_exo -52.48 -34.86 63.79 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 CA-C-N 118.88 1.34 . . . . 0.5 111.804 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.01 -50.73 11.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 1.04 110.247 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -60.19 -35.27 75.02 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.05 -1.031 . . . . 2.12 109.37 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.3 ttt -58.68 -27.32 64.71 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.391 -0.818 . . . . 2.66 109.571 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 70.0 mt -85.02 -3.77 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.694 -0.629 . . . . 1.22 110.882 -179.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.547 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.5 ptmt -66.94 -27.05 1.6 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 120.278 -1.514 . . . . 1.44 113.315 -177.929 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.9 Cg_exo -56.38 -39.33 91.98 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 CA-C-N 122.349 1.875 . . . . 0.31 112.117 -177.592 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -68.17 -46.06 71.77 Favored 'General case' 0 C--N 1.301 -1.506 0 C-N-CA 118.181 -1.408 . . . . 0.45 108.458 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -60.11 -52.1 66.79 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.914 0.864 . . . . 0.16 109.406 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -67.27 -45.57 76.24 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.7 -0.625 . . . . 0.35 110.244 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.3 m -60.2 -38.4 83.2 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.263 -0.898 . . . . 0.77 110.601 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 mt -63.08 -24.48 67.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.086 -1.009 . . . . 1.07 110.753 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.4 m -53.4 -36.24 61.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.872 -1.142 . . . . 0.87 108.745 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 mp0 -85.3 -15.98 41.57 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.035 -1.041 . . . . 2.16 108.627 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.0 -37.61 38.77 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.393 -1.336 . . . . 2.29 107.393 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -123.69 69.05 1.03 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.338 -1.356 . . . . 0.95 107.338 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -65.66 -13.45 59.21 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 108.35 -0.981 . . . . 0.89 108.35 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -82.23 -3.74 55.69 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.321 -0.992 . . . . 1.13 108.321 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.0 t -118.43 141.75 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 N-CA-C 107.463 -1.31 . . . . 1.06 107.463 178.752 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -97.96 122.38 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.172 -0.955 . . . . 1.04 109.822 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 39.1 m-85 -101.06 131.51 46.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.311 -0.868 . . . . 0.13 110.419 -179.719 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.43 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 6.4 mp -116.33 140.96 48.78 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.288 -0.883 . . . . 1.08 109.243 178.49 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -110.21 130.01 55.62 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.843 -1.54 . . . . 1.13 106.843 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.99 135.11 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.253 -0.904 . . . . 1.03 110.663 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 54.3 t0 -97.03 119.76 36.12 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.76 -0.83 . . . . 1.05 108.76 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 28.1 m -68.85 -17.63 22.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.786 -1.197 . . . . 1.04 108.213 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.529 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.5 m-20 -94.24 -41.02 9.69 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.403 -0.81 . . . . 1.08 112.041 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 41.0 m-20 -96.86 -16.56 20.69 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.598 -1.314 . . . . 1.07 108.293 179.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.09 39.89 3.86 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.03 -1.1 . . . . 1.03 108.03 179.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -60.08 -24.56 64.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.676 -0.64 . . . . 1.92 110.224 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.518 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.4 p30 -63.71 -37.33 86.94 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.812 -1.18 . . . . 1.05 108.739 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.518 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 8.1 t -70.34 -44.04 77.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.271 -0.893 . . . . 1.1 109.587 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.52 67.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.516 -0.74 . . . . 1.03 111.178 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.441 ' HG ' ' N ' ' A' ' 68' ' ' GLU . 94.7 p -60.26 -35.72 76.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.948 -1.095 . . . . 0.89 109.541 -179.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.441 ' N ' ' HG ' ' A' ' 67' ' ' SER . 14.6 tm-20 -63.65 -36.9 85.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.292 -0.88 . . . . 2.06 109.181 179.187 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.44 -2.21 58.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.23 -0.919 . . . . 1.05 110.884 -178.901 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 55.44 49.04 17.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.04 -1.038 . . . . 2.02 109.847 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.4 t -64.05 133.02 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 C-N-CA 118.574 -1.25 . . . . 1.05 108.442 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -104.86 -12.36 16.29 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.639 -0.663 . . . . 2.16 109.936 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.55 155.99 20.34 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.849 -1.157 . . . . 1.04 111.207 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -129.31 155.51 79.89 Favored Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 107.859 -1.163 . . . . 1.04 107.859 178.645 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -76.05 141.77 71.56 Favored 'Cis proline' 0 N--CA 1.493 1.469 0 C-N-CA 123.749 -1.355 . . . . 0.19 112.675 -1.957 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -127.38 137.3 52.72 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.597 -0.89 . . . . 1.04 108.597 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.556 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 90.9 m-85 -113.74 130.04 56.49 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 108.612 -0.884 . . . . 0.23 108.612 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . 0.461 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 80.9 mt-30 -120.57 140.02 52.11 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.269 -0.894 . . . . 0.43 108.673 179.341 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -107.48 133.01 52.6 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.436 0.636 . . . . 0.17 110.318 -179.168 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . 0.444 ' CZ ' ' NZ ' ' A' ' 85' ' ' LYS . 80.1 m-85 -128.61 145.92 51.0 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 108.996 -0.742 . . . . 0.17 108.996 179.513 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -147.81 131.24 16.66 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.16 -1.422 . . . . 2.18 107.16 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.474 ' HZ2' ' CG ' ' A' ' 20' ' ' ASP . 68.6 mttm 56.01 27.93 12.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.279 -0.888 . . . . 1.8 109.549 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.86 15.29 79.5 Favored Glycine 0 N--CA 1.493 2.485 0 C-N-CA 120.061 -1.066 . . . . 0.23 110.902 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -125.06 141.54 52.06 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.088 -1.243 . . . . 2.75 110.508 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.461 ' NZ ' ' OE1' ' A' ' 78' ' ' GLN . 20.3 ttmm -78.56 126.98 31.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.274 -0.892 . . . . 2.3 109.392 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.89 11.75 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.728 -0.608 . . . . 1.06 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.93 154.14 14.52 Favored Glycine 0 N--CA 1.494 2.552 0 C-N-CA 118.388 -1.863 . . . . 0.22 111.743 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 3.2 tp10 -165.14 136.49 4.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.997 -0.708 . . . . 1.93 109.642 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.543 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.9 p90 -163.26 158.5 21.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.328 -0.857 . . . . 0.16 109.947 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -127.97 160.18 32.7 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.61 0.719 . . . . 0.9 110.37 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 126.56 141.88 5.55 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.394 -1.482 . . . . 0.12 109.394 179.131 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.2 65.17 2.12 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.339 -1.095 . . . . 1.04 109.626 -179.773 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.0 97.78 5.77 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.353 -0.842 . . . . 1.36 108.77 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -33.28 73.31 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.017 -1.052 . . . . 1.6 111.174 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.18 -30.08 70.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.953 -1.092 . . . . 1.61 109.68 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.54 -34.72 74.55 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.566 -0.709 . . . . 2.02 109.337 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.4 mt -59.44 -40.07 85.59 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.551 -0.907 . . . . 1.05 108.551 179.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.95 -43.92 97.48 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 119.402 -0.919 . . . . 2.1 110.347 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.62 -44.81 77.1 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.136 -1.026 . . . . 1.06 110.624 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.0 m -64.3 -40.06 95.18 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.793 -1.192 . . . . 1.04 108.478 -179.798 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.95 -46.64 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 107.503 -1.295 . . . . 1.04 107.503 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -60.12 -35.94 76.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.05 -1.093 . . . . 1.09 108.05 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -68.73 -40.1 80.05 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.626 -0.671 . . . . 2.21 110.164 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 87.6 mt -98.26 -2.73 38.9 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.143 -0.973 . . . . 1.05 111.63 -178.522 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.2 p . . . . . 0 N--CA 1.499 1.999 0 O-C-N 120.504 -1.372 . . . . 1.08 109.551 -179.246 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.494 1.55 0 CA-C-O 121.001 0.334 . . . . 1.75 112.13 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.93 122.72 45.77 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.263 -0.898 . . . . 1.35 108.833 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 30.7 m -108.92 129.95 55.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.477 -0.764 . . . . 1.36 110.002 -179.282 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -66.61 -30.73 71.07 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.373 -0.83 . . . . 1.24 109.614 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt -59.15 -21.65 59.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.469 -0.769 . . . . 1.89 109.706 -179.101 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 36.3 mm -130.04 141.44 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.812 -0.555 . . . . 1.03 109.754 -179.554 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 24.2 m -99.9 131.51 45.83 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 106.934 -1.506 . . . . 0.19 106.934 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -84.06 142.69 30.24 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.661 -1.275 . . . . 0.93 111.441 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.454 ' C ' ' H ' ' B' ' 69' ' ' VAL . 23.4 m95 -75.44 -11.14 59.98 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.216 -0.927 . . . . 0.21 108.995 178.745 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . 0.411 ' N ' HD21 ' B' ' 68' ' ' ASN . 2.0 m120 -51.86 -13.05 0.24 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.513 -0.921 . . . . 0.49 108.513 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.454 ' H ' ' C ' ' B' ' 67' ' ' TRP . 16.0 m -60.74 140.58 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 1.66 109.362 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.24 -38.97 85.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.068 -1.02 . . . . 1.36 109.297 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 118.202 -1.332 . . . . 2.32 110.027 -179.079 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.2 ttm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.238 -0.653 . . . . 3.32 109.238 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.3 t -98.24 152.73 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.177 -0.952 . . . . 1.16 109.958 -179.444 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -130.14 126.0 36.43 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.707 -0.849 . . . . 2.18 108.707 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -98.18 124.07 42.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.633 -0.877 . . . . 0.4 108.633 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.0 mm -101.16 112.66 34.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.956 -0.757 . . . . 1.04 108.956 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.468 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.0 mp0 -95.53 -0.2 52.36 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.195 -0.94 . . . . 2.25 109.464 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -156.04 159.33 39.04 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.909 -1.119 . . . . 0.91 111.166 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -65.41 -31.92 73.27 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.174 -1.047 . . . . 2.18 108.174 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.8 m -58.01 -49.46 76.76 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.517 -0.873 . . . . 1.03 109.067 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.26 69.24 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.323 -0.86 . . . . 1.02 109.042 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.7 t80 -58.48 -43.58 89.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.037 -1.039 . . . . 0.15 108.713 179.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -64.56 -43.87 92.54 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.966 -0.753 . . . . 2.07 108.966 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.59 -36.26 83.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.645 -0.66 . . . . 1.77 110.059 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.32 80.89 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.165 -0.959 . . . . 1.04 109.19 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.7 mt -61.14 -41.18 96.27 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.186 -0.946 . . . . 1.07 109.016 -179.933 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -68.46 -35.26 77.32 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.628 -0.67 . . . . 1.07 110.508 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -39.58 81.18 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.271 -0.893 . . . . 1.07 110.234 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' A' ' 23' ' ' VAL . . . -60.85 -34.6 74.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.386 -0.821 . . . . 1.03 109.746 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -124.58 21.2 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.648 -1.381 . . . . 0.24 109.648 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -90.75 -1.53 57.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 120.982 -1.304 . . . . 1.07 110.51 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -75.02 149.99 39.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.934 -1.104 . . . . 2.03 108.805 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 10.8 mt -58.79 160.03 6.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.09 -1.006 . . . . 1.23 110.543 -179.652 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.4 ' CG2' ' CB ' ' A' ' 18' ' ' ALA . 62.9 t -148.0 111.75 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 107.974 -1.121 . . . . 1.03 107.974 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 59.8 t -103.66 144.19 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 107.47 -1.308 . . . . 1.03 107.47 179.709 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.9 t -125.34 122.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.192 -0.942 . . . . 1.01 110.549 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.541 ' CG ' ' HG ' ' A' ' 28' ' ' SER . 48.2 t0 -99.53 117.41 33.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.377 -0.827 . . . . 1.05 109.932 179.527 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -94.12 26.45 3.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.937 . . . . 0.73 110.179 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.541 ' HG ' ' CG ' ' A' ' 26' ' ' ASP . 51.9 m -60.3 144.65 50.01 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.823 -1.173 . . . . 0.84 110.16 -178.744 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.57 125.5 32.49 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.43 -0.952 . . . . 1.04 108.43 179.296 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.0 t -65.59 -32.71 74.44 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.105 -0.997 . . . . 1.08 108.729 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.551 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 54.7 p-90 -72.11 -23.22 61.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.196 -0.94 . . . . 0.29 111.03 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.5 t -81.05 123.19 28.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.768 -1.207 . . . . 0.26 108.734 -179.413 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.414 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.94 -56.53 22.0 Favored Glycine 0 N--CA 1.493 2.446 0 O-C-N 121.637 -0.664 . . . . 0.28 112.159 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.414 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 8.0 Cg_endo -59.94 -29.48 89.5 Favored 'Trans proline' 0 C--N 1.314 -1.267 0 CA-C-N 119.45 1.625 . . . . 0.5 112.605 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.22 -54.99 5.81 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.844 -1.16 . . . . 1.04 109.918 -179.985 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt -60.26 -39.32 86.36 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.085 -1.009 . . . . 2.12 109.444 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.512 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.3 tmt? -59.76 -28.92 67.8 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.653 -0.654 . . . . 2.66 109.89 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.459 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 68.0 mt -80.73 -3.7 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.708 -0.62 . . . . 1.22 110.454 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.4 ptmt -65.12 -27.6 2.3 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 120.486 -1.384 . . . . 1.44 113.295 -177.598 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.0 Cg_exo -55.93 -39.27 92.19 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 CA-C-N 122.563 1.951 . . . . 0.31 112.888 -176.227 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.12 -45.01 71.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.632 -1.292 . . . . 0.45 108.842 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.38 -52.81 63.08 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.121 -0.987 . . . . 0.16 109.454 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.0 t60 -68.22 -40.29 82.12 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.774 -0.578 . . . . 0.35 110.678 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.469 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.8 m -62.61 -39.62 94.34 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.77 111.374 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -63.92 -19.43 65.1 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.912 -1.117 . . . . 1.07 110.372 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.4 m -55.16 -38.43 68.29 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 120.755 -1.216 . . . . 0.87 108.481 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -83.2 -17.59 42.24 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.031 -1.043 . . . . 2.16 109.635 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -77.93 -35.9 49.96 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.453 -1.314 . . . . 2.29 107.453 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -122.46 68.15 0.95 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.077 -1.453 . . . . 0.95 107.077 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.8 p -66.1 -9.61 32.78 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.642 -0.873 . . . . 0.89 108.642 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -88.91 6.66 38.29 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.056 -1.09 . . . . 1.13 108.056 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 78.7 t -127.05 146.41 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 107.885 -1.154 . . . . 1.06 107.885 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.408 HG22 HD11 ' A' ' 53' ' ' ILE . 22.8 mm -99.98 123.84 53.05 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 120.822 -1.174 . . . . 1.04 109.777 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.2 m-85 -105.72 125.59 51.16 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.273 -0.892 . . . . 0.13 109.179 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.441 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 3.2 mp -110.33 141.18 43.71 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.984 -1.073 . . . . 1.08 109.566 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -110.89 131.67 54.85 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 106.517 -1.66 . . . . 1.13 106.517 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.3 t -126.49 137.52 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.404 -0.81 . . . . 1.03 110.097 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.1 t0 -99.06 119.22 37.46 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 107.821 -1.178 . . . . 1.05 107.821 179.103 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -67.99 -18.72 23.94 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 120.66 -1.275 . . . . 1.04 108.469 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.551 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -92.63 -41.19 10.33 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.548 -0.72 . . . . 1.08 111.819 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -96.48 -18.71 19.66 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.596 -1.315 . . . . 1.07 108.062 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.44 38.87 3.88 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.569 -1.271 . . . . 1.03 107.569 179.357 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -60.34 -23.51 64.31 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.702 -0.624 . . . . 1.92 109.947 -178.541 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.54 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -64.82 -38.13 89.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.696 -1.253 . . . . 1.05 109.216 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.54 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 14.2 t -70.89 -44.16 76.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 121.786 0.803 . . . . 1.1 109.618 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.99 -39.71 72.3 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.685 -0.634 . . . . 1.03 110.5 -178.45 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.4 p -59.97 -32.54 70.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.936 -1.102 . . . . 0.89 109.02 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -62.26 -39.04 91.59 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.438 -0.789 . . . . 2.06 108.901 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.22 0.2 57.31 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.559 -0.713 . . . . 1.05 110.923 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 53.29 49.97 18.63 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.996 -1.065 . . . . 2.02 109.684 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.18 133.13 30.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.735 -1.228 . . . . 1.05 108.684 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.2 -10.89 18.42 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.588 -0.695 . . . . 2.16 110.41 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.18 157.08 20.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.595 -1.316 . . . . 1.04 111.007 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -128.53 155.08 79.38 Favored Pre-proline 0 N--CA 1.501 2.115 0 N-CA-C 107.516 -1.29 . . . . 1.04 107.516 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -75.62 140.83 68.74 Favored 'Cis proline' 0 N--CA 1.493 1.461 0 C-N-CA 123.731 -1.362 . . . . 0.19 113.206 -3.488 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -126.03 137.32 53.64 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.057 -1.09 . . . . 1.04 108.057 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.434 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 90.2 m-85 -115.9 131.1 57.04 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.863 -1.162 . . . . 0.23 107.863 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -123.93 144.65 49.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.281 -0.887 . . . . 0.43 108.916 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -108.23 132.51 53.58 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.639 0.733 . . . . 0.17 110.693 -178.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -126.86 143.37 51.29 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.662 -0.866 . . . . 0.17 108.662 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -146.72 128.37 15.18 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.536 -1.283 . . . . 2.18 107.536 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.2 mttp 59.22 28.22 17.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.467 -0.938 . . . . 1.8 108.467 -178.79 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.11 18.96 79.06 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.742 -1.343 . . . . 0.23 109.742 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -123.71 139.9 53.52 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.389 -1.065 . . . . 2.75 110.957 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -80.03 123.32 27.73 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.846 -0.798 . . . . 2.3 108.846 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.4 m -123.15 9.37 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.513 -0.742 . . . . 1.06 111.122 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.0 160.26 27.24 Favored Glycine 0 N--CA 1.498 2.768 0 C-N-CA 118.795 -1.669 . . . . 0.22 110.948 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.499 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.5 tp10 -169.01 148.0 4.0 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.627 -0.925 . . . . 1.93 109.612 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.499 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 5.6 p90 -168.63 157.39 8.56 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.471 -0.768 . . . . 0.16 109.911 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -128.47 160.09 33.38 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.611 -0.681 . . . . 0.9 109.5 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.39 143.49 6.33 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.312 -1.515 . . . . 0.12 109.312 179.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.12 67.64 3.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.05 -1.265 . . . . 1.04 110.207 -179.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.82 95.31 4.66 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.478 -0.764 . . . . 1.36 108.985 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -32.21 70.97 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.143 -0.973 . . . . 1.6 111.679 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.89 -29.7 70.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.851 -1.155 . . . . 1.61 109.572 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -60.34 -35.45 75.68 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.46 0.647 . . . . 2.02 109.327 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.0 mt -59.26 -39.85 84.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 122.083 0.945 . . . . 1.05 108.709 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -62.35 -43.68 98.25 Favored 'General case' 0 C--N 1.288 -2.093 0 C-N-CA 120.104 -0.638 . . . . 2.1 110.98 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.29 -43.15 74.42 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.073 -1.017 . . . . 1.06 111.135 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.0 m -64.96 -39.91 94.19 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.825 -1.172 . . . . 1.04 110.147 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.28 -49.25 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 1.04 108.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.9 t-20 -60.56 -34.87 74.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.124 0.964 . . . . 1.09 108.653 178.898 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.8 tm-20 -67.86 -40.02 83.67 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.427 -0.796 . . . . 2.21 110.037 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.6 mt -100.2 -4.61 29.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.216 -0.928 . . . . 1.05 111.732 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.198 -1.564 . . . . 1.08 109.048 -179.004 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo . . . . . 0 N--CA 1.495 1.575 0 CA-C-O 121.113 0.38 . . . . 1.75 112.508 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.03 125.81 39.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 1.35 109.157 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.458 ' O ' ' O ' ' B' ' 64' ' ' ILE . 26.7 m -109.39 129.94 55.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.782 -0.821 . . . . 1.36 108.782 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 80.9 mt -67.97 -30.38 69.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.926 -1.109 . . . . 1.24 108.901 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt -59.88 -21.15 60.63 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.847 -0.797 . . . . 1.89 108.847 -179.897 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.458 ' O ' ' O ' ' B' ' 61' ' ' THR . 26.5 mm -131.6 144.8 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.628 0 O-C-N 121.894 -0.504 . . . . 1.03 109.822 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.88 132.08 50.48 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 107.522 -1.288 . . . . 0.19 107.522 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -82.56 140.74 33.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.807 -1.183 . . . . 0.93 111.054 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.452 ' C ' ' H ' ' B' ' 69' ' ' VAL . 20.7 m95 -76.97 -7.94 56.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.896 -1.128 . . . . 0.21 108.458 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -54.54 -11.79 0.61 Allowed 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.374 -0.972 . . . . 0.49 108.374 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.452 ' H ' ' C ' ' B' ' 67' ' ' TRP . 18.9 m -60.5 140.12 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.379 -0.826 . . . . 1.66 108.869 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -60.14 -40.4 89.68 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.41 -0.806 . . . . 1.36 110.149 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.44 -1.464 . . . . 2.32 109.44 -179.317 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.4 0.619 . . . . 3.32 109.783 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.6 t -99.12 155.26 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.437 -0.789 . . . . 1.16 109.599 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -130.09 130.01 44.31 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 108.464 -0.939 . . . . 2.18 108.464 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -98.89 122.25 41.89 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.295 -0.878 . . . . 0.4 108.878 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.421 HG22 HD11 ' A' ' 5' ' ' ILE . 26.7 mm -100.06 114.65 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 N-CA-C 108.673 -0.862 . . . . 1.04 108.673 179.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -99.77 -0.08 40.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.258 -0.902 . . . . 2.25 109.547 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -154.29 156.83 37.7 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.966 -1.084 . . . . 0.91 110.982 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -64.24 -32.21 73.71 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.974 -1.121 . . . . 2.18 107.974 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -56.49 -47.49 79.14 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.539 -0.912 . . . . 1.03 108.539 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.71 -31.6 69.7 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.439 -0.788 . . . . 1.02 109.243 178.8 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.9 t80 -58.7 -44.66 90.41 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.005 -1.059 . . . . 0.15 109.033 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -64.52 -42.2 95.93 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 108.832 -0.803 . . . . 2.07 108.832 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.58 -36.26 83.66 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.383 0.611 . . . . 1.77 110.399 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.82 77.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.301 -0.874 . . . . 1.04 108.999 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.5 mt -60.12 -40.05 88.39 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.96 -1.126 . . . . 1.07 107.96 179.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -69.81 -40.14 76.1 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.55 -0.719 . . . . 1.07 110.264 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.14 -32.37 68.87 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.37 -0.831 . . . . 1.07 110.457 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.59 -26.19 68.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.048 -1.033 . . . . 1.03 108.997 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.17 -130.91 30.04 Favored Glycine 0 N--CA 1.487 2.04 0 N-CA-C 109.8 -1.32 . . . . 0.24 109.8 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.62 3.0 56.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.233 -1.157 . . . . 1.07 110.729 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -73.44 149.49 42.38 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.886 -1.134 . . . . 2.03 109.665 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.511 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -58.52 158.72 7.25 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.056 -1.461 . . . . 1.23 107.056 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.511 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 85.3 t -143.91 109.69 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 120.93 -1.106 . . . . 1.03 108.816 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.2 t -98.64 141.27 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 108.222 -1.029 . . . . 1.03 108.222 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.9 t -124.17 122.41 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.503 -0.748 . . . . 1.01 109.518 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -99.3 116.45 31.5 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.275 -0.891 . . . . 1.05 109.633 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -92.41 20.43 6.18 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.061 -1.024 . . . . 0.73 109.875 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.29 146.09 20.13 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.735 -1.228 . . . . 0.84 110.483 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.6 122.4 30.48 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.927 -1.138 . . . . 1.04 107.927 179.144 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -63.81 -29.86 71.02 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.062 -1.055 . . . . 1.08 108.582 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.521 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 63.6 p-90 -74.88 -17.88 60.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.312 -0.867 . . . . 0.29 110.694 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -84.76 119.53 25.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.792 -1.193 . . . . 0.26 108.55 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.449 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.97 -54.14 39.33 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.894 -0.67 . . . . 0.28 112.247 -178.236 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.449 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.9 Cg_endo -60.18 -29.95 90.21 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 CA-C-N 119.286 1.543 . . . . 0.5 112.426 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.49 -48.01 20.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.051 . . . . 1.04 109.753 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -59.97 -32.48 70.86 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.18 -0.95 . . . . 2.12 109.09 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 15.1 tmm? -59.09 -26.95 65.09 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.34 -0.85 . . . . 2.66 110.041 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 6.0 mt -82.21 -5.72 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.398 -0.814 . . . . 1.22 111.223 -179.837 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.02 -30.36 7.18 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 119.802 -1.811 . . . . 1.44 113.336 -178.203 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.3 Cg_exo -60.0 -42.46 44.1 Favored 'Trans proline' 0 C--O 1.204 -1.189 0 CA-C-N 121.518 1.578 . . . . 0.31 112.027 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.22 -48.81 60.93 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 118.525 -1.27 . . . . 0.45 109.362 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.16 -52.82 63.7 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.806 0.812 . . . . 0.16 109.775 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -67.87 -40.32 83.61 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.797 -0.564 . . . . 0.35 111.033 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.492 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.6 m -64.2 -38.2 90.19 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.77 -1.206 . . . . 0.77 110.777 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.14 -20.5 65.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.141 -0.974 . . . . 1.07 111.142 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -52.95 -40.53 63.74 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 120.824 -1.173 . . . . 0.87 109.075 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -84.92 -16.64 40.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.115 -0.991 . . . . 2.16 109.432 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -76.21 -37.95 57.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.24 -1.393 . . . . 2.29 107.24 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.482 ' C ' ' H ' ' A' ' 51' ' ' ASN . 84.3 m-85 -123.63 68.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.282 -1.377 . . . . 0.95 107.282 177.765 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.3 p -62.81 -5.12 2.52 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.104 -1.073 . . . . 0.89 108.104 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.482 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.9 t-20 -80.48 -20.2 44.23 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.921 -0.77 . . . . 1.13 108.921 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 62.4 t -109.55 147.61 13.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 N-CA-C 108.465 -0.939 . . . . 1.06 108.465 -179.611 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.438 HG22 HD11 ' A' ' 53' ' ' ILE . 31.2 mm -99.77 118.36 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 108.695 -0.854 . . . . 1.04 108.695 -179.268 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 21.1 m-85 -97.43 124.99 41.81 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.021 -1.05 . . . . 0.13 109.798 179.726 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.482 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.5 mp -110.07 141.75 42.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.264 -0.898 . . . . 1.08 108.969 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -109.79 130.17 55.55 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.881 -1.526 . . . . 1.13 106.881 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.7 t -125.76 135.48 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.384 -0.822 . . . . 1.03 110.414 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.4 t0 -97.38 118.87 34.83 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.474 -0.766 . . . . 1.05 109.145 179.25 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.9 m -66.12 -20.46 27.3 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 120.584 -1.322 . . . . 1.04 108.392 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.521 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 19.0 m-20 -91.41 -44.05 9.37 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.551 -0.718 . . . . 1.08 112.077 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 70.4 m-20 -95.21 -14.46 24.05 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.582 -1.324 . . . . 1.07 108.892 -179.868 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.92 37.82 4.32 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.349 -1.352 . . . . 1.03 107.349 179.201 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -59.93 -21.17 60.79 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 121.128 0.49 . . . . 1.92 110.116 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -65.5 -39.15 91.54 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.906 -1.121 . . . . 1.05 108.482 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.529 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 15.4 t -70.95 -45.67 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.434 -0.791 . . . . 1.1 109.527 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -37.42 75.84 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.545 -0.722 . . . . 1.03 110.884 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.2 p -60.56 -38.0 83.11 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.978 -1.077 . . . . 0.89 109.845 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.1 -38.89 92.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.192 -0.942 . . . . 2.06 109.88 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -83.46 -2.97 57.11 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 1.05 109.909 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 55.08 49.84 16.63 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.357 -0.84 . . . . 2.02 109.479 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.39 130.16 27.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.708 -1.197 . . . . 1.05 108.568 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -102.28 -10.98 19.06 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.701 -0.624 . . . . 2.16 110.57 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.482 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.87 155.77 16.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.687 -1.258 . . . . 1.04 110.962 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -129.67 155.32 80.52 Favored Pre-proline 0 N--CA 1.504 2.238 0 N-CA-C 108.563 -0.902 . . . . 1.04 108.563 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -75.38 142.16 73.5 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.882 -1.299 . . . . 0.19 113.073 -2.394 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.482 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 87.2 m -127.3 136.23 51.65 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 108.553 -0.906 . . . . 1.04 108.553 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.468 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 92.7 m-85 -114.09 130.14 56.59 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 108.674 -0.861 . . . . 0.23 108.674 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -121.97 140.85 51.95 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.704 -0.85 . . . . 0.43 108.704 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -107.75 132.16 53.68 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.544 0.688 . . . . 0.17 110.887 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -127.21 149.37 50.02 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.472 0.653 . . . . 0.17 109.476 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -149.55 125.13 10.35 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.623 -1.251 . . . . 2.18 107.623 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.2 mttt 58.82 28.41 17.39 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.811 -1.181 . . . . 1.8 107.811 -178.728 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.55 13.51 83.43 Favored Glycine 0 N--CA 1.487 2.073 0 N-CA-C 110.049 -1.22 . . . . 0.23 110.049 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.7 mm-40 -114.78 134.69 54.91 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.269 -1.136 . . . . 2.75 110.409 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -81.32 121.91 26.79 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.55 -0.907 . . . . 2.3 108.55 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.2 m -125.16 16.33 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.628 -0.67 . . . . 1.06 110.607 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.43 155.47 15.15 Favored Glycine 0 N--CA 1.495 2.624 0 C-N-CA 118.924 -1.607 . . . . 0.22 110.994 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.3 tp10 -168.0 149.32 5.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.619 -0.882 . . . . 1.93 108.619 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.483 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.0 p90 -168.5 158.86 9.85 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.134 -0.979 . . . . 0.16 109.434 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -127.19 162.33 26.41 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.388 -0.82 . . . . 0.9 110.335 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.44 142.77 6.46 Favored Glycine 0 N--CA 1.503 3.119 0 N-CA-C 109.985 -1.246 . . . . 0.12 109.985 179.128 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.27 64.53 2.69 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.028 -1.278 . . . . 1.04 110.208 -179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.61 97.82 5.93 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.264 -1.013 . . . . 1.36 108.264 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -32.63 71.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.185 -0.947 . . . . 1.6 111.461 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.46 -30.82 71.88 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.975 -1.078 . . . . 1.61 109.371 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.94 -34.7 75.13 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.323 0.582 . . . . 2.02 109.58 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.9 mt -59.53 -37.81 79.34 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.039 0.923 . . . . 1.05 108.574 179.328 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -64.09 -42.04 97.07 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 120.3 -0.56 . . . . 2.1 111.425 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -43.94 77.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.961 -1.087 . . . . 1.06 111.565 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -65.75 -38.91 90.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.834 -1.166 . . . . 1.04 109.72 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.93 -49.97 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.041 -1.037 . . . . 1.04 108.405 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.3 t-20 -60.14 -34.9 74.18 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-O 122.091 0.948 . . . . 1.09 108.458 178.783 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -67.91 -39.88 83.51 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.574 -0.703 . . . . 2.21 109.938 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.8 mt -99.52 -1.69 37.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.202 -0.936 . . . . 1.05 111.414 -179.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.4 ' O ' ' CG1' ' A' ' 105' ' ' VAL . 9.2 p . . . . . 0 N--CA 1.496 1.872 0 O-C-N 120.297 -1.502 . . . . 1.08 109.1 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo . . . . . 0 N--CA 1.496 1.631 0 CA-C-O 120.902 0.293 . . . . 1.75 112.311 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -99.14 115.79 29.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.162 -0.961 . . . . 1.35 109.142 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.468 ' O ' ' O ' ' B' ' 64' ' ' ILE . 29.4 m -109.32 130.08 55.5 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.61 -0.681 . . . . 1.36 109.26 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 38.2 mt -67.49 -32.87 73.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.214 -0.929 . . . . 1.24 109.904 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -60.41 -25.97 66.34 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.302 -0.874 . . . . 1.89 109.839 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.468 ' O ' ' O ' ' B' ' 61' ' ' THR . 29.4 mm -128.88 139.86 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 109.462 -0.57 . . . . 1.03 109.462 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.8 m -100.22 127.77 46.43 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -79.47 142.37 35.91 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.811 -1.181 . . . . 0.93 111.161 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.487 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.3 m95 -78.09 -12.19 59.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.254 -0.904 . . . . 0.21 109.435 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.25 -10.97 0.65 Allowed 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.263 -1.014 . . . . 0.49 108.263 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.487 ' H ' ' C ' ' B' ' 67' ' ' TRP . 31.3 m -64.36 134.68 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 109.161 -0.681 . . . . 1.66 109.161 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -60.17 -38.02 81.92 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.073 -1.017 . . . . 1.36 109.018 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.077 -1.609 . . . . 2.32 109.077 -179.513 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 tpt . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.092 -0.707 . . . . 3.32 109.092 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.3 t -98.11 145.44 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.272 -0.893 . . . . 1.16 109.471 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -130.07 128.29 41.61 Favored 'General case' 0 N--CA 1.5 2.041 0 N-CA-C 108.214 -1.032 . . . . 2.18 108.214 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -97.07 125.23 41.39 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.202 -0.937 . . . . 0.4 109.341 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 mm -103.64 115.76 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 108.663 -0.866 . . . . 1.04 108.663 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -99.32 -0.16 41.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.137 -0.977 . . . . 2.25 109.778 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.87 155.58 37.34 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.726 -1.234 . . . . 0.91 111.068 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -65.0 -31.5 72.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.461 -0.94 . . . . 2.18 108.461 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.5 m -58.65 -47.99 82.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 1.03 109.157 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.74 66.11 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.277 -0.889 . . . . 1.02 109.143 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -60.05 -44.37 94.74 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.098 -1.001 . . . . 0.15 108.741 -179.648 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -64.75 -43.04 94.6 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.855 -0.795 . . . . 2.07 108.855 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.01 -36.49 84.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.203 0.525 . . . . 1.77 110.487 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.08 -42.05 80.96 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.266 -0.896 . . . . 1.04 109.221 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.6 mt -60.26 -40.1 89.16 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.602 -0.888 . . . . 1.07 108.602 -179.927 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -67.98 -36.78 80.6 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.485 0.66 . . . . 1.07 110.337 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.71 -39.2 84.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.485 -0.759 . . . . 1.07 110.56 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.89 -32.16 71.62 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.234 -0.916 . . . . 1.03 109.45 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.09 -124.91 17.83 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.809 -1.316 . . . . 0.24 109.809 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -91.77 4.02 53.77 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.109 -1.23 . . . . 1.07 110.367 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -76.2 147.89 38.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.047 -1.033 . . . . 2.03 109.482 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.479 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.25 158.69 8.7 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.249 -1.389 . . . . 1.23 107.249 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.479 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 88.3 t -146.07 113.09 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.633 -1.292 . . . . 1.03 108.873 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.1 t -99.69 141.33 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 108.401 -0.962 . . . . 1.03 108.401 179.839 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.8 t -124.1 123.72 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.196 -0.94 . . . . 1.01 109.681 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.8 t70 -100.98 116.66 33.34 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.407 -0.808 . . . . 1.05 110.687 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -94.41 24.2 4.68 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.23 -0.919 . . . . 0.73 110.991 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -59.56 149.28 30.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 120.756 -1.215 . . . . 0.84 110.647 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.06 124.8 32.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.175 -1.417 . . . . 1.04 107.175 178.497 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.35 -30.38 70.76 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 118.896 -1.121 . . . . 1.08 108.042 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.538 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 67.0 p-90 -75.7 -13.85 60.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.423 -0.798 . . . . 0.29 110.741 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 23.3 t -85.78 118.3 25.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.745 -1.222 . . . . 0.26 108.225 -179.895 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.42 -54.08 38.98 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 120.73 -0.748 . . . . 0.28 112.265 -177.944 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.7 Cg_endo -60.44 -29.86 89.6 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 CA-C-N 119.539 1.669 . . . . 0.5 112.183 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.2 -47.77 22.87 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.015 -1.053 . . . . 1.04 109.726 179.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -60.05 -32.11 70.61 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.252 -0.905 . . . . 2.12 109.787 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 44.6 ttm -59.93 -29.3 68.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.506 -0.746 . . . . 2.66 110.12 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -79.76 -4.52 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.701 -0.624 . . . . 1.22 111.026 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.532 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.53 -31.24 8.53 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 120.188 -1.57 . . . . 1.44 113.712 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.1 Cg_exo -59.63 -38.85 79.19 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 CA-C-N 121.756 1.663 . . . . 0.31 112.159 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -71.23 -50.69 30.36 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 118.763 -1.175 . . . . 0.45 108.894 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -59.97 -47.35 86.18 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.099 -1.001 . . . . 0.16 109.178 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -68.91 -42.37 76.97 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.588 -0.695 . . . . 0.35 111.282 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 66.3 m -65.91 -39.15 90.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.905 -1.122 . . . . 0.77 110.622 -179.23 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.93 -22.46 62.47 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.201 -0.937 . . . . 1.07 110.308 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -56.76 -35.27 68.44 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.855 -1.153 . . . . 0.87 108.835 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -89.48 -12.62 39.57 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.957 -1.089 . . . . 2.16 109.503 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 ttmm -81.84 -36.08 28.68 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.182 -1.414 . . . . 2.29 107.182 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.443 ' C ' ' H ' ' A' ' 51' ' ' ASN . 79.5 m-85 -122.09 67.34 0.92 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 107.284 -1.376 . . . . 0.95 107.284 178.577 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 p -63.61 -7.03 6.17 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 107.841 -1.17 . . . . 0.89 107.841 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.443 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.8 t-20 -80.19 -20.0 45.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.231 -0.655 . . . . 1.13 109.231 178.408 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 78.7 t -110.54 147.69 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 108.881 -0.785 . . . . 1.06 108.881 -178.975 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.435 HG22 HD11 ' A' ' 53' ' ' ILE . 28.0 mm -100.1 120.51 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.2 -0.937 . . . . 1.04 109.325 -179.005 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 24.4 m-85 -98.38 126.97 44.11 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.168 -0.957 . . . . 0.13 110.393 179.689 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.477 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.1 mp -110.31 143.69 40.14 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 108.616 -0.883 . . . . 1.08 108.616 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -112.33 129.4 56.31 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 106.809 -1.552 . . . . 1.13 106.809 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.5 t -126.93 133.39 68.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.237 -0.914 . . . . 1.03 110.495 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 51.5 t0 -96.92 120.07 36.58 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.848 -0.797 . . . . 1.05 108.848 179.724 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.92 -18.88 24.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.592 -1.318 . . . . 1.04 107.739 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.2 m-20 -90.45 -43.89 9.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.504 -0.747 . . . . 1.08 111.599 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 23.9 m-20 -95.75 -19.04 19.97 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.625 -1.297 . . . . 1.07 108.81 -179.954 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -119.61 38.75 3.8 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.641 -1.244 . . . . 1.03 107.641 179.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -60.08 -22.56 62.89 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.835 -0.541 . . . . 1.92 109.933 -178.502 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.552 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.4 p30 -65.42 -38.32 89.57 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.76 -1.213 . . . . 1.05 108.84 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.552 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -71.41 -44.03 72.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 O-C-N 121.234 -0.916 . . . . 1.1 109.647 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.52 73.59 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.442 -0.787 . . . . 1.03 110.438 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -60.83 -34.0 73.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.922 -1.111 . . . . 0.89 109.446 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -62.47 -37.77 87.26 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.882 . . . . 2.06 109.184 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.25 0.02 57.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.347 -0.845 . . . . 1.05 110.929 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 mp0 53.61 49.85 18.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.946 -1.096 . . . . 2.02 109.025 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.08 134.18 29.12 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 O-C-N 121.0 -1.063 . . . . 1.05 108.441 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -105.44 -12.78 15.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.584 -0.698 . . . . 2.16 110.339 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.61 154.44 18.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.819 -1.176 . . . . 1.04 111.116 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -125.8 156.11 71.73 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.359 -1.349 . . . . 1.04 107.359 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -77.66 142.77 72.11 Favored 'Cis proline' 0 C--N 1.316 -1.17 0 C-N-CA 123.644 -1.399 . . . . 0.19 112.074 -2.177 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.9 134.04 48.11 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 109.245 -0.65 . . . . 1.04 109.245 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.535 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 90.9 m-85 -110.7 130.49 55.56 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.72 -0.845 . . . . 0.23 108.72 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -120.63 140.26 51.81 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.397 -0.964 . . . . 0.43 108.397 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 76.0 m-85 -107.71 132.12 53.7 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.466 0.651 . . . . 0.17 110.388 -179.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -125.79 144.11 50.78 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.803 -0.814 . . . . 0.17 108.803 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -147.07 128.51 14.96 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.208 -1.404 . . . . 2.18 107.208 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 mttt 60.01 28.03 17.51 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.129 -1.063 . . . . 1.8 108.129 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.19 21.66 75.32 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 110.133 -1.187 . . . . 0.23 110.133 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.404 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.5 mm100 -128.72 137.75 51.76 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.291 -1.123 . . . . 2.75 111.012 179.967 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -77.43 125.3 29.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.46 -0.775 . . . . 2.3 109.63 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -123.97 9.1 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.617 -0.677 . . . . 1.06 110.887 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.62 154.47 12.31 Favored Glycine 0 N--CA 1.496 2.695 0 C-N-CA 118.424 -1.846 . . . . 0.22 111.538 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -166.54 150.34 7.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.635 -0.921 . . . . 1.93 109.488 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.4 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 27.0 p90 -164.33 161.94 22.05 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.273 -0.971 . . . . 0.16 109.159 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -126.64 159.96 32.1 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.669 0.747 . . . . 0.9 109.539 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.09 142.85 6.38 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.897 -1.681 . . . . 0.12 108.897 179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.98 67.86 4.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.151 -1.205 . . . . 1.04 110.142 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.51 97.19 5.53 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.417 -0.957 . . . . 1.36 108.417 178.789 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -35.43 77.4 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.098 -1.001 . . . . 1.6 111.335 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -61.81 -29.95 70.5 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.982 -1.074 . . . . 1.61 109.388 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -62.46 -33.61 75.16 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.75 -0.594 . . . . 2.02 109.404 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 38.5 mt -59.27 -39.72 83.8 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.974 -1.121 . . . . 1.05 107.974 179.411 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.88 -44.06 97.62 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.456 -0.898 . . . . 2.1 110.907 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.89 75.32 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.89 -1.131 . . . . 1.06 110.732 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -64.75 -40.59 95.55 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.833 -1.167 . . . . 1.04 109.015 -179.361 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 77.6 mt -64.46 -47.85 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 N-CA-C 107.586 -1.264 . . . . 1.04 107.586 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -59.99 -36.4 77.11 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.48 -0.933 . . . . 1.09 108.48 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -69.33 -40.23 77.71 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.684 -0.635 . . . . 2.21 110.483 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.2 mt -98.22 -2.91 38.61 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.245 -0.91 . . . . 1.05 111.554 -178.514 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.418 -1.426 . . . . 1.08 109.289 -179.804 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo . . . . . 0 N--CA 1.493 1.448 0 CA-C-O 120.907 0.294 . . . . 1.75 112.333 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.34 123.1 38.69 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.918 -1.114 . . . . 1.35 109.286 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.414 HG21 ' H ' ' B' ' 63' ' ' LYS . 21.4 m -110.49 130.65 55.51 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.464 -0.772 . . . . 1.36 108.93 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.76 -25.21 68.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.303 -0.873 . . . . 1.24 109.287 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.414 ' H ' HG21 ' B' ' 61' ' ' THR . 68.6 mmtt -61.49 -19.4 62.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.316 -0.865 . . . . 1.89 108.754 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 31.6 mm -130.22 140.36 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 109.375 -0.602 . . . . 1.03 109.375 -179.993 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.8 m -100.83 130.06 46.79 Favored 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 106.779 -1.563 . . . . 0.19 106.779 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.1 m -81.99 145.57 30.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.664 -1.272 . . . . 0.93 111.509 -177.821 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.458 ' C ' ' H ' ' B' ' 69' ' ' VAL . 24.7 m95 -80.0 -17.75 52.04 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.411 -0.806 . . . . 0.21 109.563 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -55.98 -12.0 1.27 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.176 -1.046 . . . . 0.49 108.176 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.458 ' H ' ' C ' ' B' ' 67' ' ' TRP . 7.5 p -64.9 139.37 21.51 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 N-CA-C 109.068 -0.715 . . . . 1.66 109.068 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -59.91 -39.03 84.04 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.094 -1.003 . . . . 1.36 109.769 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 109.429 -1.468 . . . . 2.32 109.429 -179.553 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.259 -0.645 . . . . 3.32 109.259 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t -98.71 141.48 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.125 0 O-C-N 121.361 -0.837 . . . . 1.16 109.86 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -130.43 129.54 43.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.287 -0.883 . . . . 2.18 108.916 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.423 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 66.3 tt0 -96.52 124.48 40.52 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.777 -1.194 . . . . 0.4 107.777 178.497 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.9 mm -102.03 115.06 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 1.04 108.893 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.423 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 30.9 mm-40 -99.17 -1.58 38.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.289 -0.882 . . . . 2.25 109.279 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 78.9 p -150.13 152.7 35.14 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.13 -0.981 . . . . 0.91 110.993 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' NZ ' ' CB ' ' A' ' 8' ' ' LYS . 2.9 ttmp? -62.83 -31.02 71.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.54 -0.911 . . . . 2.18 108.54 178.372 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.6 m -58.16 -48.62 79.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.106 -0.996 . . . . 1.03 109.495 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.06 70.56 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.257 -0.902 . . . . 1.02 108.872 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 50.1 t80 -59.79 -44.3 93.99 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.825 . . . . 0.15 109.183 -179.88 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -65.6 -42.35 91.77 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.69 0.757 . . . . 2.07 109.166 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -64.23 -39.1 93.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.641 -0.662 . . . . 1.77 110.226 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.54 85.13 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.417 -0.802 . . . . 1.04 109.029 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.4 mt -60.62 -40.15 90.8 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.239 -0.985 . . . . 1.07 108.357 179.249 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -69.52 -36.7 76.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.235 -0.916 . . . . 1.07 109.872 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.95 -36.51 78.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.299 -0.876 . . . . 1.07 110.335 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.75 -33.59 75.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.263 -0.898 . . . . 1.03 109.383 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -124.58 20.44 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.345 -1.102 . . . . 0.24 110.345 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -92.52 3.12 56.12 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.124 -1.221 . . . . 1.07 110.83 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -75.14 150.74 38.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.106 -0.996 . . . . 2.03 108.767 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.484 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.38 155.54 24.93 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.823 -1.177 . . . . 1.23 107.823 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.484 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 46.8 t -142.84 113.17 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 121.128 -0.983 . . . . 1.03 108.695 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -102.08 140.97 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 107.908 -1.145 . . . . 1.03 107.908 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.98 123.68 67.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.351 -0.843 . . . . 1.01 109.572 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.529 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.4 t70 -100.62 109.25 21.31 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.573 -0.704 . . . . 1.05 110.922 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -91.0 101.28 14.05 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 106.575 -1.639 . . . . 0.73 106.575 176.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -128.14 146.48 50.69 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.326 -0.99 . . . . 0.84 108.326 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.95 123.63 30.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.164 -1.421 . . . . 1.04 107.164 178.905 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.0 -32.09 73.08 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 118.522 -1.271 . . . . 1.08 108.545 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.403 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 53.2 p-90 -70.57 -26.16 63.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.257 -0.902 . . . . 0.29 110.636 179.313 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -83.78 115.98 22.49 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.959 -1.088 . . . . 0.26 108.134 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.468 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -63.28 -50.05 65.85 Favored Glycine 0 N--CA 1.489 2.182 0 C-N-CA 120.622 -0.799 . . . . 0.28 111.713 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 38.6 Cg_exo -52.13 -35.88 64.17 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 CA-C-N 118.913 1.357 . . . . 0.5 111.98 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.81 -53.83 7.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.434 -0.792 . . . . 1.04 110.029 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ttpp -61.11 -37.21 81.96 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.06 -1.025 . . . . 2.12 109.867 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.497 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.6 tmm? -59.2 -28.17 66.41 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.569 -0.707 . . . . 2.66 109.878 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.442 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 72.9 mt -81.69 -3.86 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.838 -0.539 . . . . 1.22 111.332 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -64.88 -27.6 2.37 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 120.368 -1.458 . . . . 1.44 113.865 -178.022 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.2 Cg_exo -56.15 -40.69 83.23 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 CA-C-N 122.215 1.827 . . . . 0.31 112.604 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -67.92 -45.21 75.01 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 117.817 -1.553 . . . . 0.45 107.877 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -60.29 -53.43 57.79 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.255 -0.903 . . . . 0.16 110.177 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -68.23 -40.09 82.13 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.517 -0.739 . . . . 0.35 110.598 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.454 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 70.0 m -62.21 -38.96 91.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.093 -1.004 . . . . 0.77 110.096 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.13 -27.28 68.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.174 -0.954 . . . . 1.07 110.105 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.7 m -50.72 -38.48 47.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.864 -1.147 . . . . 0.87 109.424 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -83.3 -13.17 55.72 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.967 -1.083 . . . . 2.16 109.377 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.4 ttmp? -82.05 -36.91 27.22 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.705 -1.22 . . . . 2.29 107.705 178.403 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -123.44 65.82 1.01 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 106.509 -1.663 . . . . 0.95 106.509 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.9 p -62.56 -8.87 7.12 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.154 -1.054 . . . . 0.89 108.154 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -89.9 8.44 32.18 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 1.13 108.48 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.2 t -127.27 148.93 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 107.698 -1.223 . . . . 1.06 107.698 178.617 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 21.9 mm -99.88 121.08 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.049 -1.032 . . . . 1.04 109.945 -178.311 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 55.6 m-85 -104.45 124.6 49.54 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.201 -0.937 . . . . 0.13 109.909 179.22 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.428 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.9 mp -110.5 143.62 40.58 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.952 -1.092 . . . . 1.08 109.833 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -112.8 130.05 56.22 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.74 -1.578 . . . . 1.13 106.74 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.08 140.43 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.916 0.865 . . . . 1.03 111.537 -177.458 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.414 ' O ' ' N ' ' A' ' 62' ' ' ALA . 58.3 t0 -102.7 118.07 36.03 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.633 -0.877 . . . . 1.05 108.633 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.0 m -69.73 -15.09 19.04 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 120.697 -1.252 . . . . 1.04 108.794 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.403 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.6 m-20 -95.42 -41.69 8.86 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.457 -0.777 . . . . 1.08 111.047 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 59.1 m-20 -97.53 -18.66 18.85 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.072 -1.018 . . . . 1.07 108.552 179.975 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.414 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -122.66 39.15 4.0 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 107.223 -1.399 . . . . 1.03 107.223 178.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.708 HE21 ' H ' ' A' ' 64' ' ' ASP . 1.6 pm0 -60.16 -22.96 63.53 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.779 -0.646 . . . . 1.92 110.019 -178.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.708 ' H ' HE21 ' A' ' 63' ' ' GLN . 2.1 p30 -63.2 -36.21 82.87 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.943 -1.098 . . . . 1.05 109.202 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.526 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 13.8 t -73.64 -43.91 53.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.465 -0.772 . . . . 1.1 109.71 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.33 -39.06 68.47 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.768 -0.582 . . . . 1.03 111.309 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.3 p -60.21 -38.78 84.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.978 -1.076 . . . . 0.89 109.946 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.91 -36.5 84.13 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 2.06 109.206 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.03 -0.63 55.07 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.395 -0.816 . . . . 1.05 111.194 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.69 49.84 17.16 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.939 -1.101 . . . . 2.02 109.785 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.6 t -65.38 130.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 C-N-CA 118.329 -1.348 . . . . 1.05 108.276 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -102.15 -12.71 17.85 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.72 -0.613 . . . . 2.16 110.237 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.477 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.82 156.21 17.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.746 -1.221 . . . . 1.04 110.814 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.6 p -129.74 154.27 80.96 Favored Pre-proline 0 N--CA 1.504 2.23 0 N-CA-C 108.06 -1.089 . . . . 1.04 108.06 178.903 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -74.8 144.95 82.59 Favored 'Cis proline' 0 N--CA 1.496 1.665 0 C-N-CA 123.811 -1.329 . . . . 0.19 112.435 -2.49 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -130.33 136.12 48.79 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 108.57 -0.9 . . . . 1.04 108.57 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.529 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.5 m-85 -109.68 129.54 55.59 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.663 -0.648 . . . . 0.23 109.313 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -121.96 137.58 54.74 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.683 -0.858 . . . . 0.43 108.683 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -105.26 133.77 49.48 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.735 -0.603 . . . . 0.17 110.271 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -127.43 143.96 51.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.17 109.357 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -145.92 127.13 14.77 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 107.868 -1.16 . . . . 2.18 107.868 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.2 mttt 59.75 28.51 17.98 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.211 -1.033 . . . . 1.8 108.211 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.07 22.52 73.79 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.757 -1.337 . . . . 0.23 109.757 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -127.75 137.26 52.37 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.347 -1.09 . . . . 2.75 110.61 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -81.04 126.31 31.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.202 -0.936 . . . . 2.3 109.76 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.26 8.33 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.671 -0.643 . . . . 1.06 110.399 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.89 155.98 16.86 Favored Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.626 -1.749 . . . . 0.22 111.815 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -166.16 149.18 7.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.92 -0.753 . . . . 1.93 109.454 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.42 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 20.6 p90 -164.15 160.68 21.68 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.08 -1.048 . . . . 0.16 109.459 177.927 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -124.96 162.79 23.72 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.615 0.722 . . . . 0.9 109.86 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.55 137.57 5.53 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.135 -1.586 . . . . 0.12 109.135 -179.955 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.02 67.78 2.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.179 -1.189 . . . . 1.04 110.232 -179.302 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -119.21 100.12 7.13 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.256 -1.016 . . . . 1.36 108.256 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.89 -34.7 73.89 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.492 -0.755 . . . . 1.6 112.36 -178.413 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.03 -29.89 71.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.538 -1.351 . . . . 1.61 109.553 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.83 -38.38 81.87 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.926 -0.768 . . . . 2.02 108.926 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 42.9 mt -57.76 -39.88 78.43 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.853 0.835 . . . . 1.05 108.929 179.678 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.81 -41.59 99.36 Favored 'General case' 0 C--N 1.293 -1.873 0 C-N-CA 119.825 -0.75 . . . . 2.1 110.611 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.01 77.28 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.106 -0.996 . . . . 1.06 111.861 -178.676 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -39.58 93.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 120.544 -1.348 . . . . 1.04 109.67 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.5 mt -61.05 -49.9 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.101 -0.999 . . . . 1.04 108.818 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 24.0 t-20 -60.18 -34.39 73.53 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.32 -0.992 . . . . 1.09 108.32 178.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -67.83 -38.5 83.28 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.696 -0.627 . . . . 2.21 109.752 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.5 mt -101.99 -0.13 34.23 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.299 -0.875 . . . . 1.05 111.56 -179.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.3 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 1.08 109.232 -179.172 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo . . . . . 0 N--CA 1.494 1.524 0 CA-C-O 121.342 0.476 . . . . 1.75 112.282 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.31 128.58 34.94 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.134 -0.979 . . . . 1.35 109.61 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.433 ' O ' ' O ' ' B' ' 64' ' ' ILE . 24.8 m -111.57 129.27 56.12 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.526 -0.734 . . . . 1.36 109.159 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.7 -30.25 70.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.204 -0.935 . . . . 1.24 109.59 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.1 mmtt -64.16 -20.3 65.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.376 -0.828 . . . . 1.89 109.49 -179.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.433 ' O ' ' O ' ' B' ' 61' ' ' THR . 31.1 mm -130.25 140.47 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.865 -0.522 . . . . 1.03 110.057 -179.266 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 59.9 m -98.15 124.64 42.8 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 107.325 -1.361 . . . . 0.19 107.325 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 60.9 m -77.65 141.55 39.36 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.942 -1.098 . . . . 0.93 111.575 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.478 ' C ' ' H ' ' B' ' 69' ' ' VAL . 21.5 m95 -76.38 -9.57 58.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.21 109.274 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . 0.449 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.9 m120 -52.7 -11.52 0.22 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.109 -0.994 . . . . 0.49 108.715 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.478 ' H ' ' C ' ' B' ' 67' ' ' TRP . 23.4 m -61.01 145.09 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.367 -0.833 . . . . 1.66 109.692 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -59.48 -36.8 76.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 1.36 109.624 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.903 -1.498 . . . . 2.32 109.685 179.723 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mmm . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.021 -0.733 . . . . 3.32 109.021 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.1 t -98.83 132.88 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.3 -0.875 . . . . 1.16 109.41 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -132.01 130.68 41.72 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.617 -0.883 . . . . 2.18 108.617 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -99.35 122.86 43.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.348 -0.845 . . . . 0.4 108.886 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.69 115.25 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.372 -0.83 . . . . 1.04 108.792 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.457 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 53.4 mp0 -97.52 -0.71 45.5 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.376 -0.827 . . . . 2.25 109.415 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -154.0 153.11 31.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.021 -1.049 . . . . 0.91 111.198 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.84 -32.4 73.61 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.445 -0.946 . . . . 2.18 108.445 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.3 m -58.96 -46.44 88.06 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.999 -1.111 . . . . 1.03 107.999 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.92 -30.7 69.22 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.634 -0.876 . . . . 1.02 108.634 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 53.7 t80 -59.83 -43.79 94.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.109 -0.994 . . . . 0.15 108.964 179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -65.36 -41.29 94.0 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.831 -0.803 . . . . 2.07 108.831 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.9 -35.34 79.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.663 -0.648 . . . . 1.77 110.237 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.81 82.92 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.284 -0.885 . . . . 1.04 109.234 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 69.3 mt -61.52 -40.39 94.45 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.334 -0.854 . . . . 1.07 108.807 179.709 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -70.05 -36.83 75.29 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.417 -0.802 . . . . 1.07 110.185 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.11 90.14 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.361 -0.837 . . . . 1.07 110.338 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -32.66 71.52 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.381 -0.824 . . . . 1.03 109.847 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.08 -126.8 23.75 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.31 -1.116 . . . . 0.24 110.31 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -91.75 5.27 50.45 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.892 -1.358 . . . . 1.07 110.978 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -77.58 151.83 34.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.128 -0.983 . . . . 2.03 109.469 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.453 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.03 156.91 16.76 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.489 -1.3 . . . . 1.23 107.489 179.78 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.453 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 77.8 t -143.75 117.99 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.856 -1.153 . . . . 1.03 108.859 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.0 142.08 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 107.813 -1.18 . . . . 1.03 107.813 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.45 123.76 66.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.351 -0.843 . . . . 1.01 109.205 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.473 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.1 t70 -100.82 118.1 36.22 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.473 -0.767 . . . . 1.05 109.633 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -95.18 22.8 6.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.306 -0.871 . . . . 0.73 109.902 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.3 m -59.04 148.01 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.027 -1.045 . . . . 0.84 110.779 -178.452 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.13 123.82 32.6 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.074 -1.084 . . . . 1.04 108.074 179.233 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.0 t -65.26 -34.51 78.52 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 118.916 -1.114 . . . . 1.08 108.192 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.543 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 57.0 p-90 -70.12 -23.28 63.0 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.218 -0.927 . . . . 0.29 111.003 179.032 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.2 t -82.68 112.89 19.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.734 -1.229 . . . . 0.26 107.992 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.455 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.85 -50.58 66.17 Favored Glycine 0 N--CA 1.489 2.211 0 C-N-CA 120.329 -0.939 . . . . 0.28 111.246 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.1 Cg_exo -51.45 -37.82 62.51 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 CA-C-N 119.011 1.406 . . . . 0.5 111.958 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.49 -47.5 19.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.057 -1.027 . . . . 1.04 109.909 -179.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.54 -31.52 69.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.135 -0.978 . . . . 2.12 109.127 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.511 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -59.91 -29.74 68.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.473 -0.767 . . . . 2.66 109.967 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 15.5 mt -80.78 -5.07 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.523 -0.736 . . . . 1.22 111.325 -179.073 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.526 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.28 -31.52 9.36 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 119.988 -1.695 . . . . 1.44 113.669 -176.857 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -59.9 -37.46 85.66 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 CA-C-N 121.898 1.714 . . . . 0.31 112.067 -178.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -71.62 -51.4 23.41 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 118.371 -1.332 . . . . 0.45 108.175 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.87 -46.7 88.46 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.38 -0.825 . . . . 0.16 109.039 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.14 -45.65 73.02 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.493 -0.755 . . . . 0.35 110.846 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.7 m -61.62 -39.92 93.0 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.085 -1.009 . . . . 0.77 111.154 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.6 mt -61.33 -22.31 64.79 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.269 -0.894 . . . . 1.07 110.852 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -55.51 -38.25 68.96 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 120.981 -1.074 . . . . 0.87 108.714 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -86.21 -16.66 37.03 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.251 -0.905 . . . . 2.16 109.263 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -76.58 -35.75 57.96 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.325 -1.361 . . . . 2.29 107.325 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -123.9 67.92 1.04 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 107.552 -1.277 . . . . 0.95 107.552 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.7 p -64.06 -7.73 9.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.578 -0.897 . . . . 0.89 108.578 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -89.16 5.48 44.46 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.115 -1.069 . . . . 1.13 108.115 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.4 t -128.0 143.08 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 N-CA-C 107.605 -1.257 . . . . 1.06 107.605 178.796 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.5 mm -99.21 122.55 51.1 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.913 -1.117 . . . . 1.04 109.203 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.8 m-85 -100.76 129.01 46.59 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.298 -0.876 . . . . 0.13 109.219 179.336 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.452 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.3 mp -112.52 141.52 46.19 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.357 -0.839 . . . . 1.08 109.138 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -109.94 132.62 53.99 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.673 -1.603 . . . . 1.13 106.673 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -130.45 132.0 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.27 -0.894 . . . . 1.03 110.26 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.443 ' O ' ' N ' ' A' ' 62' ' ' ALA . 57.6 t0 -95.64 120.96 36.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 1.05 108.52 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.87 -20.52 26.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 120.659 -1.276 . . . . 1.04 107.989 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.543 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.1 m-20 -90.25 -43.2 10.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.618 -0.676 . . . . 1.08 111.506 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -95.75 -14.2 23.54 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.561 -1.337 . . . . 1.07 108.237 179.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.443 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 39.72 3.9 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.21 -1.404 . . . . 1.03 107.21 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -60.08 -26.93 66.58 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.628 -0.67 . . . . 1.92 109.362 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.499 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.33 -37.48 87.21 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.029 -1.044 . . . . 1.05 108.969 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.499 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 7.6 t -70.28 -47.26 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.236 -0.915 . . . . 1.1 109.797 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.33 -36.92 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.446 -0.784 . . . . 1.03 110.788 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -61.07 -32.59 72.23 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.027 -1.046 . . . . 0.89 109.57 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.9 -35.73 80.68 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.246 -0.908 . . . . 2.06 109.283 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.02 -0.22 56.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.281 -0.887 . . . . 1.05 110.857 -178.952 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 54.62 50.06 16.77 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.056 -1.027 . . . . 2.02 109.954 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.2 t -67.45 132.38 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 120.938 -1.101 . . . . 1.05 108.731 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -104.6 -12.63 16.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.671 -0.643 . . . . 2.16 110.66 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.8 153.42 16.77 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.499 -1.376 . . . . 1.04 110.841 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -124.84 155.26 70.43 Favored Pre-proline 0 N--CA 1.501 2.122 0 N-CA-C 108.038 -1.097 . . . . 1.04 108.038 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -76.44 143.16 75.38 Favored 'Cis proline' 0 N--CA 1.493 1.457 0 C-N-CA 123.844 -1.315 . . . . 0.19 112.538 -2.914 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.9 m -128.97 136.12 49.92 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.11 -0.7 . . . . 1.04 109.11 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.473 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.8 m-85 -112.01 129.64 56.13 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.778 -0.823 . . . . 0.23 108.778 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 63.0 mt-30 -121.49 137.75 54.59 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.843 -1.169 . . . . 0.43 107.843 179.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -105.56 134.59 48.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.722 -0.611 . . . . 0.17 110.978 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -128.1 148.99 50.6 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.47 0.653 . . . . 0.17 109.546 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.546 ' HZ1' ' NZ ' ' A' ' 82' ' ' LYS . 54.4 tttm -150.74 125.62 9.79 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.74 -1.207 . . . . 2.18 107.74 179.449 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.546 ' NZ ' ' HZ1' ' A' ' 81' ' ' LYS . 55.1 mttp 60.03 28.17 17.68 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 108.956 -0.757 . . . . 1.8 108.956 -178.776 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.2 21.46 70.38 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.113 -1.195 . . . . 0.23 110.113 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -129.51 140.21 51.32 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.328 -1.101 . . . . 2.75 110.596 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -77.79 129.12 35.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.551 -0.718 . . . . 2.3 109.063 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.4 m -123.24 8.03 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.683 -0.636 . . . . 1.06 110.39 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.81 14.6 Favored Glycine 0 N--CA 1.497 2.704 0 C-N-CA 118.433 -1.842 . . . . 0.22 112.059 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -164.13 149.44 10.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 122.005 -0.703 . . . . 1.93 109.87 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 8.2 p90 -163.81 159.57 21.37 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.389 -0.82 . . . . 0.16 109.967 177.693 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.4 p -126.2 160.46 30.2 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.867 0.842 . . . . 0.9 110.253 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.34 140.78 5.6 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.652 -1.779 . . . . 0.12 108.652 179.827 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.32 62.91 3.8 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.184 -1.186 . . . . 1.04 110.193 -179.338 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.4 t-20 -117.48 101.82 8.69 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.89 -1.152 . . . . 1.36 107.89 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.32 -31.45 69.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.484 -0.76 . . . . 1.6 111.747 -178.831 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.94 -29.56 69.46 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.721 -1.237 . . . . 1.61 109.551 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.429 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 74.4 tttt -60.07 -34.09 72.97 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 108.353 -0.98 . . . . 2.02 108.353 -179.25 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.1 mt -59.87 -40.04 87.3 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.61 -0.885 . . . . 1.05 108.61 179.014 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -63.09 -42.4 99.61 Favored 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.916 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.55 78.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.185 -0.947 . . . . 1.06 111.278 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.04 -39.31 90.06 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 120.753 -1.217 . . . . 1.04 109.873 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.4 mt -61.38 -47.49 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.001 -1.062 . . . . 1.04 108.511 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 18.9 t-20 -60.41 -35.63 76.24 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 121.821 0.82 . . . . 1.09 108.922 178.819 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.29 -39.72 86.01 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.75 -0.594 . . . . 2.21 109.886 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 73.4 mt -99.35 -2.65 35.78 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.236 -0.915 . . . . 1.05 111.046 -179.025 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.521 -1.362 . . . . 1.08 109.019 -179.373 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo . . . . . 0 N--CA 1.496 1.642 0 CA-C-O 121.474 0.531 . . . . 1.75 111.718 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -90.1 124.95 35.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.403 -0.81 . . . . 1.35 108.993 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 25.9 m -109.39 126.75 53.76 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.326 -0.859 . . . . 1.36 109.7 -179.221 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -70.65 -25.97 63.24 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.433 -0.792 . . . . 1.24 109.936 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp -65.09 -17.8 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.441 -0.787 . . . . 1.89 109.283 -178.701 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 33.1 mm -129.29 140.1 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 121.813 -0.555 . . . . 1.03 109.821 -179.321 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.6 m -101.64 132.15 47.47 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.725 -1.213 . . . . 0.19 107.725 178.072 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.0 m -81.66 141.55 33.54 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.726 -1.234 . . . . 0.93 110.994 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.481 ' C ' ' H ' ' B' ' 69' ' ' VAL . 23.6 m95 -76.21 -12.55 60.11 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.292 -0.88 . . . . 0.21 108.904 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -53.33 -11.39 0.3 Allowed 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.36 -0.978 . . . . 0.49 108.36 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' B' ' 67' ' ' TRP . 13.8 m -60.44 139.6 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 119.544 -0.862 . . . . 1.66 109.563 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -60.43 -37.43 80.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.572 -0.705 . . . . 1.36 110.259 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 118.0 -1.444 . . . . 2.32 109.533 -179.18 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.3 mmm . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.177 -0.675 . . . . 3.32 109.177 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 78.5 t -97.99 145.24 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 O-C-N 121.257 -0.902 . . . . 1.16 109.845 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.4 tptt -129.56 125.34 36.03 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 107.83 -1.174 . . . . 2.18 107.83 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -96.55 122.62 39.66 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.847 -0.798 . . . . 0.4 108.847 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.9 111.95 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 108.487 -0.931 . . . . 1.04 108.487 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.458 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.9 mp0 -95.65 -0.44 51.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.138 -0.976 . . . . 2.25 109.844 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.412 ' HG ' ' H ' ' A' ' 10' ' ' ALA . 80.4 p -155.58 156.3 34.85 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.79 -1.194 . . . . 0.91 111.782 -179.912 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -61.87 -31.7 71.99 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.225 -1.028 . . . . 2.18 108.225 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.408 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 60.0 m -58.51 -49.91 75.67 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.503 -0.879 . . . . 1.03 108.818 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.412 ' H ' ' HG ' ' A' ' 7' ' ' SER . . . -68.43 -29.03 67.59 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.933 -0.766 . . . . 1.02 108.933 179.045 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.75 -44.52 93.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 0.15 109.351 179.923 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -65.01 -44.02 90.56 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.424 -0.797 . . . . 2.07 109.305 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.533 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.84 -39.45 94.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.704 -0.623 . . . . 1.77 110.414 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.19 95.36 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.374 -0.829 . . . . 1.04 109.057 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 35.6 mt -60.25 -41.06 92.42 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.315 -0.866 . . . . 1.07 109.011 179.771 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -70.02 -36.16 74.87 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.359 -0.838 . . . . 1.07 110.474 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.46 78.71 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.132 -0.98 . . . . 1.07 110.965 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.62 -31.48 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.897 -1.127 . . . . 1.03 109.675 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.95 -124.67 20.83 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.989 -1.244 . . . . 0.24 109.989 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.462 ' CG ' ' HZ2' ' A' ' 82' ' ' LYS . 65.2 m-20 -91.85 0.33 57.49 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.999 -1.294 . . . . 1.07 110.706 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -74.78 150.1 39.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.838 -1.164 . . . . 2.03 109.646 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 8.2 mt -57.39 159.94 4.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.961 -1.087 . . . . 1.23 109.316 179.1 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.1 t -146.65 107.92 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 108.102 -1.073 . . . . 1.03 108.102 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.6 t -102.46 136.26 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 N-CA-C 107.595 -1.261 . . . . 1.03 107.595 179.684 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.9 t -118.18 123.05 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.201 -0.937 . . . . 1.01 109.742 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -98.97 119.78 38.31 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 1.05 109.928 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -97.85 24.91 6.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.23 -0.919 . . . . 0.73 110.401 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -59.88 148.26 35.49 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.036 -1.04 . . . . 0.84 110.403 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.39 124.54 32.11 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.687 -1.227 . . . . 1.04 107.687 178.623 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.09 -33.61 74.86 Favored 'General case' 0 C--N 1.298 -1.638 0 C-N-CA 118.877 -1.129 . . . . 1.08 108.703 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.538 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 53.4 p-90 -69.95 -21.63 63.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.147 -0.971 . . . . 0.29 110.447 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.1 t -84.59 112.01 20.04 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.974 -1.079 . . . . 0.26 108.342 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.431 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.92 -52.05 55.57 Favored Glycine 0 N--CA 1.491 2.349 0 C-N-CA 120.862 -0.685 . . . . 0.28 111.64 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -51.23 -35.28 52.21 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 CA-C-N 119.062 1.431 . . . . 0.5 111.72 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.66 17.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.587 -0.696 . . . . 1.04 109.816 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.0 -32.15 70.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.28 -0.887 . . . . 2.12 109.533 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 19.1 ttt -59.81 -27.76 66.87 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 2.66 108.998 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.5 mt -82.2 -7.72 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.782 -0.574 . . . . 1.22 111.868 -179.34 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.93 -31.13 8.6 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 119.858 -1.776 . . . . 1.44 114.168 -177.472 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.9 Cg_exo -58.61 -38.61 88.63 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.616 1.613 . . . . 0.31 112.579 -178.06 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -69.29 -51.07 40.9 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 118.773 -1.171 . . . . 0.45 108.954 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.63 -50.81 72.44 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.248 -0.908 . . . . 0.16 109.508 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -67.47 -44.24 79.07 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.744 -0.597 . . . . 0.35 111.522 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.455 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.5 -37.1 84.73 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.953 -1.092 . . . . 0.77 110.496 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.73 -25.42 67.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 1.07 110.315 -178.584 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.0 m -51.62 -38.35 54.27 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.075 -1.016 . . . . 0.87 108.633 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -85.87 -17.03 36.72 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.4 -0.812 . . . . 2.16 109.415 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -77.66 -37.34 50.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 107.594 -1.261 . . . . 2.29 107.594 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -121.85 67.25 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 106.699 -1.593 . . . . 0.95 106.699 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.5 p -63.44 -10.1 15.74 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.856 -0.794 . . . . 0.89 108.856 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -90.99 8.84 33.26 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.6 -0.889 . . . . 1.13 108.6 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 70.0 t -127.12 145.72 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 107.406 -1.331 . . . . 1.06 107.406 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.428 HG22 HD11 ' A' ' 53' ' ' ILE . 26.1 mm -100.31 120.61 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 120.978 -1.076 . . . . 1.04 109.989 -178.79 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.6 m-85 -102.96 127.78 50.05 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.006 -1.059 . . . . 0.13 109.891 179.277 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.425 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.2 mp -110.06 141.4 42.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.984 -1.073 . . . . 1.08 109.489 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -110.14 132.88 53.77 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.316 -1.364 . . . . 1.13 107.316 178.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 39.6 t -130.23 131.92 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.157 -0.964 . . . . 1.03 110.839 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.9 t0 -95.2 119.97 34.62 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.135 -1.061 . . . . 1.05 108.135 178.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.11 -20.1 25.37 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 C-N-CA 118.749 -1.181 . . . . 1.04 108.532 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.9 m-20 -91.72 -41.36 10.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.486 -0.759 . . . . 1.08 111.806 -178.917 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -95.91 -14.78 22.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 120.408 -1.433 . . . . 1.07 108.236 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.98 38.9 4.09 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.601 -1.259 . . . . 1.03 107.601 179.263 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -59.84 -26.58 65.92 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 109.414 -0.587 . . . . 1.92 109.414 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.12 -36.29 83.56 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.804 -1.185 . . . . 1.05 109.495 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.461 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.2 t -73.26 -43.12 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 120.961 -1.087 . . . . 1.1 109.694 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.9 -37.83 67.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.379 -0.826 . . . . 1.03 110.394 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 84.8 p -60.99 -33.91 73.98 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.09 -1.007 . . . . 0.89 108.467 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -60.64 -40.02 90.41 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.538 -0.726 . . . . 2.06 109.056 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.18 4.58 50.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.331 -0.856 . . . . 1.05 110.869 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 52.25 50.13 19.06 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.884 -1.135 . . . . 2.02 110.545 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.35 132.13 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.778 -1.201 . . . . 1.05 108.87 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -103.92 -9.89 18.58 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.719 -0.613 . . . . 2.16 109.611 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.477 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.45 155.79 20.33 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.772 -1.205 . . . . 1.04 111.772 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -126.04 154.3 73.98 Favored Pre-proline 0 N--CA 1.499 1.976 0 N-CA-C 107.566 -1.272 . . . . 1.04 107.566 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -78.86 140.06 56.93 Favored 'Cis proline' 0 N--CA 1.487 1.144 0 C-N-CA 123.657 -1.393 . . . . 0.19 111.97 -2.067 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -124.22 132.89 53.63 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.885 -0.783 . . . . 1.04 108.885 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.524 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.6 m-85 -110.67 131.48 55.01 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.938 -0.764 . . . . 0.23 108.938 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -121.63 140.4 52.31 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.605 -0.887 . . . . 0.43 108.605 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.5 m-85 -107.87 131.15 54.8 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.397 0.617 . . . . 0.17 109.679 -179.721 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -125.62 148.98 48.78 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 109.082 -0.71 . . . . 0.17 109.082 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -147.31 127.74 14.03 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.182 -1.414 . . . . 2.18 107.182 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.462 ' HZ2' ' CG ' ' A' ' 20' ' ' ASP . 40.4 mttm 56.09 33.26 21.62 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.057 -1.027 . . . . 1.8 108.89 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.56 24.72 76.45 Favored Glycine 0 N--CA 1.484 1.883 0 N-CA-C 109.82 -1.312 . . . . 0.23 109.82 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.1 mm100 -129.23 135.92 49.43 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.513 -0.993 . . . . 2.75 110.809 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -73.69 129.99 39.07 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.093 -1.004 . . . . 2.3 109.651 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.0 10.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.864 -0.523 . . . . 1.06 110.09 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 164.01 161.78 13.77 Favored Glycine 0 N--CA 1.496 2.658 0 C-N-CA 118.373 -1.87 . . . . 0.22 112.051 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -165.25 154.65 12.65 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.872 -0.781 . . . . 1.93 109.325 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 5.8 p90 -166.92 157.03 11.38 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.886 -0.726 . . . . 0.16 109.355 178.465 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -125.54 160.91 28.38 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.608 -0.682 . . . . 0.9 109.418 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.7 143.34 6.11 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.532 -1.827 . . . . 0.12 108.532 -179.672 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.15 64.04 4.85 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.171 -1.193 . . . . 1.04 109.146 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.83 98.4 6.48 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 108.336 -0.987 . . . . 1.36 108.336 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -34.77 72.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.448 -0.782 . . . . 1.6 111.312 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -62.57 -29.37 70.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.206 -0.934 . . . . 1.61 109.257 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -60.9 -37.62 82.87 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.603 -0.686 . . . . 2.02 109.149 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.05 -39.79 83.11 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.232 -1.025 . . . . 1.05 108.232 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.37 -44.01 96.02 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.051 -0.66 . . . . 2.1 110.503 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.64 -44.08 62.37 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.966 -1.084 . . . . 1.06 111.318 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.4 m -63.2 -40.03 96.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.644 -1.285 . . . . 1.04 109.739 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 69.2 mt -62.1 -50.09 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.221 -0.924 . . . . 1.04 108.551 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 21.9 t-20 -60.87 -34.35 74.48 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 122.023 0.916 . . . . 1.09 108.758 179.194 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -67.61 -39.87 84.74 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.525 -0.734 . . . . 2.21 110.208 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 75.8 mt -101.3 -3.13 29.46 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.019 -1.051 . . . . 1.05 111.493 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.6 p . . . . . 0 N--CA 1.5 2.036 0 O-C-N 120.392 -1.442 . . . . 1.08 109.678 -179.021 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 N--CA 1.495 1.596 0 CA-C-O 121.212 0.421 . . . . 1.75 111.745 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.86 124.83 39.12 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.212 -0.93 . . . . 1.35 109.503 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.408 ' O ' ' O ' ' B' ' 64' ' ' ILE . 24.0 m -111.18 129.91 55.8 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.815 -0.809 . . . . 1.36 108.815 179.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -65.75 -30.95 71.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 1.24 109.811 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -65.55 -16.6 63.85 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.438 -0.789 . . . . 1.89 109.541 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.408 ' O ' ' O ' ' B' ' 61' ' ' THR . 32.9 mm -130.0 140.78 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 N-CA-C 109.592 -0.521 . . . . 1.03 109.592 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 16.9 m -101.61 129.49 47.74 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 107.159 -1.423 . . . . 0.19 107.159 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.5 m -81.15 143.93 32.03 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.887 -1.133 . . . . 0.93 111.802 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.477 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 27.6 m95 -76.79 -10.92 59.71 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.052 -1.03 . . . . 0.21 109.24 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -53.07 -10.96 0.21 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.625 -0.88 . . . . 0.49 108.625 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.467 ' H ' ' C ' ' B' ' 67' ' ' TRP . 31.0 m -64.34 141.59 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.38 -0.825 . . . . 1.66 109.377 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -59.38 -38.93 81.73 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.436 -0.79 . . . . 1.36 109.434 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 CA-C-O 117.921 -1.488 . . . . 2.32 109.79 -179.847 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.472 ' C ' ' SD ' ' A' ' 1' ' ' MET . 1.4 tmt? . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 108.963 -0.754 . . . . 3.32 108.963 . . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.417 ' O ' ' SD ' ' A' ' 1' ' ' MET . 90.5 t -101.41 154.67 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.372 -0.83 . . . . 1.16 109.747 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt -130.12 127.37 39.64 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.418 -0.956 . . . . 2.18 108.418 179.879 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -94.91 125.31 39.49 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.166 -0.959 . . . . 0.4 109.265 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.4 mm -100.56 116.36 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.404 -0.961 . . . . 1.04 108.404 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -99.64 -2.8 34.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.396 -0.815 . . . . 2.25 109.433 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -152.57 155.99 38.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 119.257 -0.977 . . . . 0.91 111.189 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -62.33 -33.81 75.42 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.924 -1.139 . . . . 2.18 107.924 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.2 m -56.0 -49.39 73.77 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 118.962 -1.095 . . . . 1.03 108.96 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.24 69.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.665 -0.865 . . . . 1.02 108.665 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -59.77 -43.14 94.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.023 -1.048 . . . . 0.15 109.069 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -65.49 -41.61 93.08 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 108.33 -0.989 . . . . 2.07 108.33 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -66.57 -35.73 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.785 -0.572 . . . . 1.77 109.941 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.919 . . . . 1.04 108.746 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 55.3 mt -61.37 -42.66 99.07 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.419 -0.956 . . . . 1.07 108.419 179.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -68.49 -37.08 79.79 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.622 -0.674 . . . . 1.07 110.053 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.61 -38.63 84.22 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.336 -0.852 . . . . 1.07 109.64 -179.224 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.82 69.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.119 -0.988 . . . . 1.03 110.331 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -128.05 26.05 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.276 -1.13 . . . . 0.24 110.276 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -91.65 3.48 54.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.141 -1.211 . . . . 1.07 109.957 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.4 mttp -75.16 149.16 39.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.022 -1.048 . . . . 2.03 109.44 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.451 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.08 154.9 18.23 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.752 -1.203 . . . . 1.23 107.752 -179.637 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.451 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 92.5 t -142.57 109.75 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.996 -1.065 . . . . 1.03 108.99 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.3 t -100.12 141.16 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 107.783 -1.191 . . . . 1.03 107.783 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -123.42 121.69 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 O-C-N 120.893 -1.13 . . . . 1.01 109.978 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.563 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.55 121.72 40.85 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.359 -0.838 . . . . 1.05 110.11 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -97.13 21.36 9.97 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.126 -0.984 . . . . 0.73 110.226 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.42 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 52.3 m -54.16 147.06 13.65 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.045 -1.034 . . . . 0.84 111.306 -178.627 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.94 126.19 33.3 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.843 -1.169 . . . . 1.04 107.843 178.778 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.8 t -66.93 -36.56 82.52 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.646 -1.284 . . . . 1.08 108.477 179.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 57.3 p-90 -69.9 -22.6 63.21 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.333 -0.854 . . . . 0.29 111.761 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.9 t -83.77 118.39 23.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.715 -1.241 . . . . 0.26 108.806 -179.275 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . . . . . . . . . . . -61.06 -54.39 37.14 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 120.1 -1.048 . . . . 0.28 111.074 -179.128 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 38.5 Cg_exo -50.69 -38.58 56.21 Favored 'Trans proline' 0 C--N 1.309 -1.549 0 CA-C-N 119.074 1.437 . . . . 0.5 111.95 179.981 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.72 -49.96 19.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 1.04 110.504 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -60.42 -38.12 83.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.091 -1.006 . . . . 2.12 109.391 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 22.5 ttt -57.42 -28.61 63.43 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.477 -0.765 . . . . 2.66 110.183 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 63.6 mt -85.18 -2.81 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.829 -0.544 . . . . 1.22 111.047 -179.328 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.572 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 3.4 ptmt -64.16 -29.54 3.99 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 120.111 -1.618 . . . . 1.44 112.979 -178.592 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.0 Cg_exo -56.62 -41.67 73.4 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 121.525 1.581 . . . . 0.31 113.116 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.61 ' CE1' ' NZ ' ' A' ' 94' ' ' LYS . 31.3 m-85 -68.15 -44.7 75.43 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.249 -1.532 . . . . 0.45 108.575 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -61.14 -53.9 51.19 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.79 0.805 . . . . 0.16 110.342 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -68.24 -42.27 79.97 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.77 -0.582 . . . . 0.35 111.404 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.492 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.4 m -60.52 -37.76 82.2 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.102 -0.999 . . . . 0.77 110.692 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 mt -63.15 -21.74 66.4 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.84 -1.163 . . . . 1.07 110.792 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.0 m -51.56 -39.43 57.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.613 -1.304 . . . . 0.87 108.916 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -82.46 -16.5 48.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.434 -0.791 . . . . 2.16 109.598 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -78.28 -36.68 46.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.091 -1.448 . . . . 2.29 107.091 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -124.18 67.85 1.06 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 107.353 -1.351 . . . . 0.95 107.353 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -63.86 -10.44 20.6 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.574 -0.899 . . . . 0.89 108.574 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -89.25 6.16 41.55 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.349 -0.982 . . . . 1.13 108.349 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 43.4 t -126.07 143.67 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 N-CA-C 107.289 -1.374 . . . . 1.06 107.289 179.439 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.448 HD11 HG22 ' A' ' 53' ' ' ILE . 32.6 mm -99.89 120.35 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 121.043 -1.036 . . . . 1.04 110.0 -178.199 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -100.83 128.64 46.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.157 -0.965 . . . . 0.13 109.496 179.534 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.409 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 2.8 mp -110.34 140.01 44.97 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 120.945 -1.097 . . . . 1.08 109.771 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -110.1 132.01 54.54 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.777 -1.564 . . . . 1.13 106.777 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -130.13 130.19 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.06 -1.025 . . . . 1.03 110.437 -178.213 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 47.6 t0 -93.0 121.07 33.96 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.27 -1.011 . . . . 1.05 108.27 179.444 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -68.37 -19.0 23.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.689 -1.257 . . . . 1.04 108.362 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.2 m-20 -92.66 -39.83 11.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.45 -0.781 . . . . 1.08 112.126 -179.183 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -98.02 -14.39 20.57 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.708 -1.245 . . . . 1.07 108.199 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -126.83 39.32 3.94 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 107.586 -1.264 . . . . 1.03 107.586 179.802 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -59.79 -23.18 63.07 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 115.748 -0.66 . . . . 1.92 110.097 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.539 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.36 -39.99 94.97 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.94 -1.1 . . . . 1.05 109.177 179.619 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.539 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -69.54 -45.13 78.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 O-C-N 121.125 -0.985 . . . . 1.1 110.108 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.35 69.75 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.623 -0.673 . . . . 1.03 110.699 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.3 p -60.31 -39.43 86.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.936 -1.103 . . . . 0.89 109.981 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -62.88 -37.08 85.48 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.148 -0.97 . . . . 2.06 109.336 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.64 0.49 50.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.149 -0.97 . . . . 1.05 110.248 -179.618 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 52.28 50.25 18.79 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.868 -1.145 . . . . 2.02 109.375 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 35.3 t -64.17 134.57 28.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 120.46 -1.4 . . . . 1.05 108.138 -179.007 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -106.51 -12.38 15.63 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.501 -0.749 . . . . 2.16 109.987 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.49 155.02 21.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.96 -1.088 . . . . 1.04 110.378 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.62 155.72 80.8 Favored Pre-proline 0 N--CA 1.506 2.361 0 N-CA-C 107.596 -1.261 . . . . 1.04 107.596 178.539 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -73.03 142.87 76.08 Favored 'Cis proline' 0 N--CA 1.495 1.615 0 CA-C-N 120.22 1.114 . . . . 0.19 112.759 -2.321 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 89.8 m -130.1 129.97 44.24 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.511 -0.922 . . . . 1.04 108.511 178.424 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.563 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.8 m-85 -106.94 130.32 54.62 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.23 109.741 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 71.7 mt-30 -122.07 139.88 53.19 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.162 -0.961 . . . . 0.43 109.256 178.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -105.82 137.76 43.15 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.496 0.665 . . . . 0.17 110.448 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.82 150.27 52.06 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.82 -0.807 . . . . 0.17 108.82 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -147.16 129.37 15.64 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.562 -1.273 . . . . 2.18 107.562 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.7 mttt 52.0 32.26 9.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.836 -1.165 . . . . 1.8 109.04 -178.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.83 21.65 76.15 Favored Glycine 0 N--CA 1.483 1.811 0 N-CA-C 110.452 -1.059 . . . . 0.23 110.452 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -127.87 142.48 51.26 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.298 -1.119 . . . . 2.75 110.26 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -76.84 127.34 32.56 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.46 -0.775 . . . . 2.3 109.456 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -121.35 1.56 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.562 -0.711 . . . . 1.06 110.442 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.92 163.69 31.02 Favored Glycine 0 N--CA 1.5 2.903 0 C-N-CA 118.701 -1.714 . . . . 0.22 111.57 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.486 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.4 tp10 -166.7 149.97 6.88 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.53 -0.983 . . . . 1.93 109.178 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.486 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.6 p90 -168.76 157.72 8.56 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.084 -1.01 . . . . 0.16 109.794 177.338 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -126.76 164.51 21.18 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.602 -0.687 . . . . 0.9 109.736 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.37 145.26 8.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.849 -1.301 . . . . 0.12 109.849 179.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.77 68.04 4.65 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.552 -0.97 . . . . 1.04 109.524 179.783 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.477 ' ND2' ' OE1' ' A' ' 95' ' ' GLU . 0.7 OUTLIER -119.15 91.69 3.62 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 108.334 -0.988 . . . . 1.36 108.334 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.61 ' NZ ' ' CE1' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -67.27 -30.98 71.01 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.636 -0.665 . . . . 1.6 111.55 -178.841 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . 0.477 ' OE1' ' ND2' ' A' ' 93' ' ' ASN . 55.2 mp0 -67.42 -30.12 69.78 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.809 -1.182 . . . . 1.61 109.144 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.35 -35.26 75.25 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.268 -0.895 . . . . 2.02 108.762 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.1 mt -59.56 -38.96 82.5 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.904 0.859 . . . . 1.05 108.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -62.83 -43.38 98.94 Favored 'General case' 0 C--N 1.294 -1.816 0 C-N-CA 119.997 -0.681 . . . . 2.1 111.043 -178.127 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -43.8 70.7 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.114 -0.991 . . . . 1.06 112.032 -178.248 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -63.18 -39.5 94.83 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.943 -1.098 . . . . 1.04 109.996 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.417 ' O ' ' N ' ' A' ' 105' ' ' VAL . 49.4 mt -62.89 -49.19 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 120.984 -1.073 . . . . 1.04 108.391 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.86 -36.62 77.25 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.84 -1.17 . . . . 1.09 107.84 179.002 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -67.17 -39.54 86.47 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.62 -0.675 . . . . 2.21 109.718 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -100.82 0.57 38.91 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.839 -1.163 . . . . 1.05 111.683 -178.88 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.417 ' N ' ' O ' ' A' ' 101' ' ' ILE . 7.9 p . . . . . 0 N--CA 1.497 1.892 0 O-C-N 120.191 -1.568 . . . . 1.08 109.395 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 N--CA 1.491 1.346 0 CA-C-O 120.912 0.297 . . . . 1.75 112.632 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -92.24 119.59 31.99 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.867 -1.146 . . . . 1.35 109.965 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.422 ' O ' ' O ' ' B' ' 64' ' ' ILE . 28.6 m -115.68 130.03 56.7 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.898 -0.778 . . . . 1.36 108.898 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.61 -30.67 71.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 1.24 109.74 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.413 ' H ' HG23 ' B' ' 61' ' ' THR . 71.2 mmtt -62.49 -23.64 67.04 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.286 -0.884 . . . . 1.89 110.331 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.422 ' O ' ' O ' ' B' ' 61' ' ' THR . 31.2 mm -130.51 142.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 N-CA-C 109.728 -0.471 . . . . 1.03 109.728 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.4 m -97.69 129.55 44.74 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.635 -1.617 . . . . 0.19 106.635 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -79.53 139.86 37.42 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.894 -1.129 . . . . 0.93 111.307 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' B' ' 69' ' ' VAL . 24.0 m95 -74.42 -11.51 60.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.674 -0.641 . . . . 0.21 109.273 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . 0.407 ' N ' HD21 ' B' ' 68' ' ' ASN . 2.1 m120 -49.24 -13.16 0.06 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.399 -0.813 . . . . 0.49 109.033 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.505 ' N ' ' O ' ' B' ' 67' ' ' TRP . 15.9 m -63.43 146.1 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 N-CA-C 108.373 -0.973 . . . . 1.66 108.373 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -59.13 -40.43 85.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.763 -1.211 . . . . 1.36 109.345 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.077 0 CA-C-O 117.929 -1.484 . . . . 2.32 109.468 -179.993 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptp . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.356 0.598 . . . . 3.32 110.005 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 98.9 t -99.43 158.6 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.285 -0.884 . . . . 1.16 109.868 -179.481 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 tptt -130.06 129.56 43.78 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 108.546 -0.909 . . . . 2.18 108.546 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -96.45 124.01 40.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.201 -0.937 . . . . 0.4 108.653 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.433 HG22 HD11 ' A' ' 5' ' ' ILE . 29.2 mm -100.73 113.78 37.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 N-CA-C 108.364 -0.976 . . . . 1.04 108.364 179.442 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.74 -3.7 32.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.278 -0.889 . . . . 2.25 109.321 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -152.49 155.9 38.37 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.22 -0.925 . . . . 0.91 110.612 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -64.59 -31.84 73.23 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.349 -0.982 . . . . 2.18 108.349 178.642 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.7 m -55.64 -47.87 75.91 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.416 -0.913 . . . . 1.03 109.018 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.08 -30.24 69.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.427 -0.796 . . . . 1.02 109.177 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 48.6 t80 -59.69 -45.23 92.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.189 -0.944 . . . . 0.15 109.237 -179.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -63.87 -41.41 97.76 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 108.89 -0.781 . . . . 2.07 108.89 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.98 -37.21 86.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.677 -0.639 . . . . 1.77 110.006 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.45 80.32 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.369 -0.832 . . . . 1.04 109.42 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 85.1 mt -60.21 -40.12 88.99 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.444 -0.947 . . . . 1.07 108.444 -179.847 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.83 -34.77 74.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.625 -0.672 . . . . 1.07 109.925 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.7 85.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.283 -0.886 . . . . 1.07 109.91 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.47 -31.87 71.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.246 -0.909 . . . . 1.03 109.999 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.49 18.38 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.687 -1.365 . . . . 0.24 109.687 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.541 ' OD1' ' NZ ' ' A' ' 82' ' ' LYS . 62.9 m-20 -91.77 2.52 56.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -1.102 . . . . 1.07 110.374 -179.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -76.02 149.16 37.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.98 -1.075 . . . . 2.03 109.593 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.492 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.84 159.57 8.81 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.487 -1.301 . . . . 1.23 107.487 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.492 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 96.1 t -146.9 109.94 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 O-C-N 120.823 -1.173 . . . . 1.03 108.82 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.7 t -98.27 142.27 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 N-CA-C 107.971 -1.122 . . . . 1.03 107.971 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.96 121.0 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.455 -0.778 . . . . 1.01 109.488 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.552 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.9 t70 -98.67 119.74 37.92 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.395 -0.816 . . . . 1.05 110.404 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -96.18 21.67 8.61 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.456 -0.777 . . . . 0.73 109.743 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -57.29 145.01 33.47 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.978 -1.076 . . . . 0.84 109.945 -178.476 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.9 127.43 33.5 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.678 -1.23 . . . . 1.04 107.678 179.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -68.59 -31.7 71.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.827 -1.149 . . . . 1.08 108.822 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.513 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 60.6 p-90 -73.22 -20.81 60.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.066 -1.021 . . . . 0.29 110.838 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 21.6 t -81.88 122.64 28.0 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.834 -1.166 . . . . 0.26 108.54 -179.333 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.461 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.42 -54.04 34.86 Favored Glycine 0 N--CA 1.489 2.175 0 C-N-CA 120.748 -0.739 . . . . 0.28 111.822 -178.439 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.2 Cg_endo -60.56 -30.0 89.71 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 CA-C-N 119.398 1.599 . . . . 0.5 112.533 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.39 -54.19 6.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.072 -1.017 . . . . 1.04 109.695 179.888 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -61.35 -38.15 85.91 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.305 -0.872 . . . . 2.12 109.673 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.44 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 35.5 ttm -59.88 -28.17 67.31 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.46 -0.775 . . . . 2.66 109.529 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.431 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 66.4 mt -80.94 -4.41 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.847 -0.533 . . . . 1.22 110.735 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.546 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.2 ptmt -64.36 -26.07 1.79 Allowed Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 120.364 -1.46 . . . . 1.44 113.174 -178.081 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.546 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.5 Cg_exo -57.42 -40.29 82.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 122.468 1.917 . . . . 0.31 112.663 -177.1 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -67.9 -46.16 72.38 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 118.204 -1.398 . . . . 0.45 108.196 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -60.18 -53.9 52.23 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.125 -0.985 . . . . 0.16 109.884 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.0 t60 -68.09 -40.17 82.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.595 -0.691 . . . . 0.35 111.391 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.463 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.51 -39.16 92.62 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.855 -1.153 . . . . 0.77 110.643 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.86 -21.91 65.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.183 -0.948 . . . . 1.07 110.368 -178.554 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.3 m -53.51 -34.95 59.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.854 -1.154 . . . . 0.87 108.478 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 44.8 mp0 -88.75 -14.9 36.05 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.486 -0.759 . . . . 2.16 109.123 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.13 -37.79 37.71 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.708 -1.219 . . . . 2.29 107.708 178.874 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -123.13 68.87 0.99 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 106.861 -1.533 . . . . 0.95 106.861 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.8 p -63.38 -8.53 9.13 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.932 -0.766 . . . . 0.89 108.932 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -90.98 8.94 32.74 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.275 -0.891 . . . . 1.13 108.62 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 42.8 t -127.29 144.97 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.685 -1.228 . . . . 1.06 107.685 178.849 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -99.82 123.65 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.009 -1.057 . . . . 1.04 109.473 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 44.3 m-85 -104.81 125.25 50.67 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.424 -0.798 . . . . 0.13 109.7 179.802 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.466 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.7 mp -110.0 142.7 41.03 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.121 -0.987 . . . . 1.08 109.196 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -109.95 131.7 54.82 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.908 -1.516 . . . . 1.13 106.908 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.0 t -128.28 137.76 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.325 -0.859 . . . . 1.03 110.6 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.4 ' O ' ' N ' ' A' ' 62' ' ' ALA . 58.0 t0 -100.17 119.0 37.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 1.05 108.905 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -67.96 -17.54 22.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 120.394 -1.441 . . . . 1.04 108.149 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.513 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.3 m-20 -90.01 -42.72 10.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 1.08 111.458 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -97.66 -22.15 16.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.651 -1.28 . . . . 1.07 109.276 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.4 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -115.96 38.39 3.35 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.146 -1.427 . . . . 1.03 107.146 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.614 HE21 ' H ' ' A' ' 64' ' ' ASP . 1.8 pm0 -60.34 -20.49 59.54 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.814 -0.63 . . . . 1.92 109.65 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.614 ' H ' HE21 ' A' ' 63' ' ' GLN . 1.5 p30 -63.76 -37.92 89.19 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.959 -1.088 . . . . 1.05 108.933 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.418 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 14.8 t -74.38 -43.55 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.327 -0.858 . . . . 1.1 109.532 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.26 -39.64 78.31 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.491 -0.755 . . . . 1.03 111.005 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.9 p -62.64 -35.68 80.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.915 -1.116 . . . . 0.89 109.166 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.6 -38.45 91.16 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.489 -0.757 . . . . 2.06 109.569 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.72 -0.19 56.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.282 -0.886 . . . . 1.05 111.285 -178.76 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 54.87 50.31 15.91 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.866 -1.146 . . . . 2.02 110.42 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.9 t -65.66 132.24 31.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 120.941 -1.1 . . . . 1.05 109.114 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -103.83 -11.94 17.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.601 -0.687 . . . . 2.16 110.693 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.463 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.9 155.27 16.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.81 -1.181 . . . . 1.04 110.348 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -126.74 155.92 74.41 Favored Pre-proline 0 N--CA 1.498 1.959 0 N-CA-C 107.6 -1.259 . . . . 1.04 107.6 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -75.99 143.91 78.14 Favored 'Cis proline' 0 N--CA 1.487 1.098 0 C-N-CA 123.681 -1.383 . . . . 0.19 112.541 -1.709 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.463 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.82 133.79 48.13 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.517 -0.92 . . . . 1.04 108.517 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.552 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -113.33 131.47 55.95 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.538 -0.912 . . . . 0.23 108.538 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -122.54 141.62 51.48 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.273 -0.892 . . . . 0.43 108.684 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -107.8 132.64 53.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.697 -0.627 . . . . 0.17 110.582 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -125.28 147.39 49.13 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.368 0.604 . . . . 0.17 109.499 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -148.36 124.33 10.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.305 -0.872 . . . . 2.18 109.025 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.541 ' NZ ' ' OD1' ' A' ' 20' ' ' ASP . 50.8 mttm 59.63 29.08 18.63 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.715 -1.217 . . . . 1.8 107.715 -178.976 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.24 20.58 77.1 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.593 -1.403 . . . . 0.23 109.593 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.404 ' NE2' ' HA ' ' A' ' 84' ' ' GLN . 3.6 mm100 -124.21 137.02 54.57 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.483 -1.01 . . . . 2.75 110.965 -179.85 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.64 125.42 29.34 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.1 -1.0 . . . . 2.3 108.851 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 m -124.62 13.89 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.724 -0.61 . . . . 1.06 110.703 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.45 157.55 18.63 Favored Glycine 0 N--CA 1.499 2.88 0 C-N-CA 118.969 -1.586 . . . . 0.22 111.066 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.482 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.92 148.44 7.33 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.553 -0.906 . . . . 1.93 108.553 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.482 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 3.5 p90 -168.23 157.59 9.43 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.241 -0.912 . . . . 0.16 109.749 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -126.52 159.88 32.16 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.529 -0.732 . . . . 0.9 110.041 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.95 143.7 6.62 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.805 -1.318 . . . . 0.12 109.805 178.969 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.91 64.76 3.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.19 -1.182 . . . . 1.04 109.81 -179.932 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.42 94.25 4.48 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.015 -1.106 . . . . 1.36 108.015 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -31.44 71.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.04 -1.037 . . . . 1.6 111.129 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -65.3 -29.77 70.56 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.905 -1.122 . . . . 1.61 109.351 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -60.42 -34.31 73.78 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.916 -0.772 . . . . 2.02 108.916 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.67 -38.81 82.5 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.051 0.929 . . . . 1.05 108.74 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.2 -43.72 98.2 Favored 'General case' 0 C--N 1.292 -1.918 0 C-N-CA 119.785 -0.766 . . . . 2.1 110.909 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.78 -44.0 74.56 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 1.06 111.861 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.4 m -64.79 -40.06 94.62 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.741 -1.224 . . . . 1.04 109.64 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.6 mt -60.79 -49.58 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.339 -0.986 . . . . 1.04 108.339 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.6 t-20 -60.35 -35.18 75.08 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.99 0.9 . . . . 1.09 108.581 178.728 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.81 -39.58 87.75 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.864 -0.523 . . . . 2.21 109.6 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 82.5 mt -99.63 -2.86 34.47 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.197 -0.94 . . . . 1.05 111.631 -179.133 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.496 1.842 0 O-C-N 120.545 -1.347 . . . . 1.08 109.515 -179.098 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo . . . . . 0 N--CA 1.493 1.456 0 CA-C-O 121.297 0.457 . . . . 1.75 112.31 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -91.64 121.39 33.26 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.199 -0.938 . . . . 1.35 108.907 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 23.7 m -106.91 129.88 54.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.308 -0.87 . . . . 1.36 109.371 -179.606 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 90.5 mt -62.97 -29.89 71.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.472 -0.768 . . . . 1.24 109.756 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm -60.03 -19.68 53.99 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.815 -0.809 . . . . 1.89 108.815 -179.302 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 28.5 mm -131.5 140.0 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 O-C-N 121.864 -0.522 . . . . 1.03 109.732 179.916 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.0 m -96.4 128.44 43.33 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.156 -1.424 . . . . 0.19 107.156 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 55.2 m -77.61 141.6 39.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.723 -1.235 . . . . 0.93 110.751 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.486 ' C ' ' H ' ' B' ' 69' ' ' VAL . 25.7 m95 -76.94 -11.83 59.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.439 -0.788 . . . . 0.21 108.912 178.89 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -52.94 -11.09 0.2 Allowed 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.586 -0.894 . . . . 0.49 108.586 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.486 ' H ' ' C ' ' B' ' 67' ' ' TRP . 15.6 m -61.8 140.45 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.639 -0.824 . . . . 1.66 109.133 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -60.15 -39.7 87.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.266 -0.896 . . . . 1.36 109.741 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.101 0 N-CA-C 108.927 -1.669 . . . . 2.32 108.927 -179.364 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 mmt . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.055 -0.721 . . . . 3.32 109.055 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.42 137.57 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.386 -0.821 . . . . 1.16 109.235 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -130.61 128.96 42.08 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.256 -0.902 . . . . 2.18 108.874 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -97.86 121.88 40.31 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.235 -1.024 . . . . 0.4 108.235 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.0 mm -99.99 112.89 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 1.04 108.743 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.04 -0.03 47.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 2.25 109.903 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -153.53 156.39 37.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.707 -1.246 . . . . 0.91 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -65.06 -33.0 74.99 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.318 -0.993 . . . . 2.18 108.318 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 90.0 m -56.14 -48.05 76.99 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.871 -0.788 . . . . 1.03 108.871 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.67 -29.69 66.08 Favored 'General case' 0 C--N 1.295 -1.763 0 O-C-N 121.545 -0.722 . . . . 1.02 109.089 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.9 t80 -59.66 -44.09 93.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.188 -0.945 . . . . 0.15 109.164 -179.707 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -65.92 -43.93 86.65 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.834 -0.802 . . . . 2.07 108.834 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -63.59 -36.31 83.38 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.465 0.65 . . . . 1.77 110.068 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.97 -43.84 78.08 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.349 -0.845 . . . . 1.04 109.439 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.88 -40.14 91.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.441 -0.787 . . . . 1.07 109.321 -179.994 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -69.48 -32.61 71.61 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.426 -0.796 . . . . 1.07 110.448 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.68 83.04 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 1.07 109.355 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.82 -36.11 80.18 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.511 -0.743 . . . . 1.03 109.625 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.48 -123.27 16.29 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.976 -1.249 . . . . 0.24 109.976 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -91.15 3.75 53.98 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.195 -1.18 . . . . 1.07 110.224 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -77.14 149.18 35.65 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.994 -1.066 . . . . 2.03 109.768 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.43 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.3 153.72 21.88 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.834 -1.173 . . . . 1.23 107.834 -179.798 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.43 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 57.3 t -143.97 120.73 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 N-CA-C 107.995 -1.113 . . . . 1.03 107.995 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -108.03 140.08 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.456 -0.942 . . . . 1.03 108.456 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -123.25 119.9 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.327 -0.858 . . . . 1.01 109.462 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.568 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 25.6 t70 -97.37 108.96 21.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.496 -0.753 . . . . 1.05 110.8 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.98 103.03 15.73 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.268 -1.753 . . . . 0.73 106.268 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.4 m -130.07 150.05 51.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.016 -0.735 . . . . 0.84 109.016 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -87.61 120.97 29.46 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.455 -1.313 . . . . 1.04 107.455 178.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -65.73 -32.21 73.63 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 118.541 -1.264 . . . . 1.08 108.039 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.409 ' CD1' ' OD1' ' A' ' 60' ' ' ASP . 53.3 p-90 -70.73 -23.77 62.51 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.32 -0.863 . . . . 0.29 111.063 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -84.43 115.13 22.38 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.827 -1.171 . . . . 0.26 108.751 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.454 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.72 -50.75 64.3 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 120.819 -0.705 . . . . 0.28 111.787 -178.272 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.2 Cg_exo -51.97 -36.18 63.55 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 CA-C-N 118.826 1.313 . . . . 0.5 112.866 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.5 -47.83 21.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.128 -0.982 . . . . 1.04 109.623 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.28 -35.68 76.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 2.12 109.097 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.54 ' O ' ' SD ' ' A' ' 37' ' ' MET . 11.6 tmm? -59.64 -29.36 67.98 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.516 -0.74 . . . . 2.66 110.06 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 71.0 mt -82.71 -1.32 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.539 -0.726 . . . . 1.22 110.822 -178.545 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.538 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.96 -30.12 6.43 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 120.535 -1.353 . . . . 1.44 113.976 -178.832 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.38 -40.6 66.08 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 CA-C-N 121.618 1.614 . . . . 0.31 113.266 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -68.8 -49.66 56.73 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 118.365 -1.334 . . . . 0.45 109.303 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.33 -51.08 71.06 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 121.761 0.791 . . . . 0.16 109.34 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.7 t60 -66.73 -40.96 88.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.621 -0.674 . . . . 0.35 110.724 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.437 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 72.3 m -63.39 -39.02 93.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.903 -1.123 . . . . 0.77 110.498 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.34 -23.08 66.57 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 1.07 111.366 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.4 m -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.788 -1.195 . . . . 0.87 108.364 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -88.94 -15.56 33.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.273 -0.892 . . . . 2.16 109.355 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 13.2 tmtt? -79.26 -33.81 43.17 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.151 -1.425 . . . . 2.29 107.151 179.417 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 71.3 m-85 -122.16 64.43 0.93 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 106.776 -1.564 . . . . 0.95 106.776 177.613 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.5 p -61.86 -9.29 6.4 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.74 -0.837 . . . . 0.89 108.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -91.1 8.63 34.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.506 -0.746 . . . . 1.13 109.207 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.0 t -128.24 152.72 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 N-CA-C 108.225 -1.028 . . . . 1.06 108.225 178.883 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -102.73 122.12 54.69 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.148 -0.97 . . . . 1.04 110.132 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 54.0 m-85 -105.49 130.05 53.65 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.238 -0.914 . . . . 0.13 109.868 179.445 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.44 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 4.4 mp -114.29 143.14 45.36 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.307 -0.871 . . . . 1.08 109.495 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -113.66 131.08 56.28 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 106.954 -1.499 . . . . 1.13 106.954 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.4 t -128.43 136.46 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 O-C-N 121.215 -0.928 . . . . 1.03 111.344 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.4 t0 -99.49 120.01 38.94 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.932 -0.766 . . . . 1.05 108.932 178.94 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.7 m -68.25 -16.7 21.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 O-C-N 120.523 -1.361 . . . . 1.04 108.471 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.6 m-20 -94.47 -40.76 9.72 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.426 -0.796 . . . . 1.08 111.448 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 76.5 m-20 -96.84 -16.79 20.59 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.796 -1.19 . . . . 1.07 108.62 179.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.61 40.67 3.67 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.489 -1.3 . . . . 1.03 107.489 179.0 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.09 -20.31 57.51 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.879 -0.513 . . . . 1.92 110.206 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.492 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.7 p30 -65.56 -38.65 90.17 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.683 -1.26 . . . . 1.05 109.176 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.492 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 20.1 t -72.76 -42.57 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.199 -0.938 . . . . 1.1 109.459 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.71 -41.95 71.25 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.484 -0.76 . . . . 1.03 110.999 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.7 p -60.14 -36.08 76.72 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.869 -1.144 . . . . 0.89 108.533 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -64.41 -39.28 93.54 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.475 -0.766 . . . . 2.06 109.492 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.56 0.45 54.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.25 -0.906 . . . . 1.05 111.019 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 54.14 50.07 17.33 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.917 -1.115 . . . . 2.02 110.059 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -65.58 131.69 31.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.787 -1.196 . . . . 1.05 109.043 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -103.71 -14.36 16.13 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.717 -0.614 . . . . 2.16 109.937 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.461 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.6 152.33 15.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.938 -1.101 . . . . 1.04 110.769 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.4 p -127.49 154.4 77.44 Favored Pre-proline 0 N--CA 1.503 2.176 0 N-CA-C 107.736 -1.209 . . . . 1.04 107.736 179.022 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -76.22 141.19 69.57 Favored 'Cis proline' 0 N--CA 1.495 1.59 0 C-N-CA 124.147 -1.189 . . . . 0.19 112.991 -1.889 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.2 m -126.72 139.2 53.32 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.498 -0.927 . . . . 1.04 108.498 177.845 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.568 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.8 m-85 -112.61 131.8 55.45 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.349 -0.982 . . . . 0.23 108.349 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.98 139.9 53.59 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.432 -0.951 . . . . 0.43 108.432 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -107.68 129.6 55.0 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.542 0.687 . . . . 0.17 110.034 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -122.58 143.27 49.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.753 -0.832 . . . . 0.17 108.753 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -146.28 130.61 17.61 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.426 -1.694 . . . . 2.18 106.426 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.2 mttt 58.17 27.75 15.52 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 108.449 -0.945 . . . . 1.8 108.449 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.3 17.26 80.1 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.893 -1.283 . . . . 0.23 109.893 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.3 mm100 -123.33 138.48 54.6 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.449 -1.03 . . . . 2.75 111.107 -179.346 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -79.58 124.44 28.53 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.352 -0.842 . . . . 2.3 109.347 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.2 m -121.53 6.81 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.529 -0.732 . . . . 1.06 110.648 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.34 155.56 15.31 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 118.666 -1.731 . . . . 0.22 111.321 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -164.25 149.89 10.61 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.812 -0.816 . . . . 1.93 109.546 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.407 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 17.8 p90 -163.01 161.81 25.65 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.92 -1.112 . . . . 0.16 109.151 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -127.0 162.38 26.14 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.485 0.66 . . . . 0.9 110.276 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.27 141.66 6.78 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.465 -1.454 . . . . 0.12 109.465 179.393 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.01 64.88 1.97 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.34 -1.094 . . . . 1.04 109.795 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.47 95.9 5.17 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.558 -0.904 . . . . 1.36 108.558 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -34.1 73.15 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.248 -0.908 . . . . 1.6 111.212 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.24 -30.1 70.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.806 -1.184 . . . . 1.61 108.783 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -61.98 -34.43 76.14 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.746 -0.596 . . . . 2.02 109.404 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 50.8 mt -59.87 -39.93 86.93 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.13 0.967 . . . . 1.05 108.888 179.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -61.65 -43.64 98.48 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.581 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.29 -44.09 76.25 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.282 -0.886 . . . . 1.06 111.629 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.4 -40.02 92.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.733 -1.229 . . . . 1.04 109.659 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.6 mt -60.94 -49.48 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.206 -1.035 . . . . 1.04 108.206 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.5 t-20 -60.12 -34.78 73.98 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.48 -0.933 . . . . 1.09 108.48 179.146 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -67.91 -40.05 83.48 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.688 -0.632 . . . . 2.21 110.325 -178.643 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.9 mt -98.77 -3.68 35.09 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.148 -0.97 . . . . 1.05 111.117 -179.221 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.492 1.631 0 O-C-N 120.548 -1.345 . . . . 1.08 109.076 -179.036 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo . . . . . 0 N--CA 1.494 1.536 0 CA-C-O 121.366 0.486 . . . . 1.75 111.632 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.77 122.59 46.03 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 108.699 -0.852 . . . . 1.35 108.699 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.9 m -103.31 128.08 50.47 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.424 -0.797 . . . . 1.36 109.301 -179.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.1 mt -69.6 -26.53 64.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.365 -0.834 . . . . 1.24 109.401 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt -60.6 -19.68 58.45 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.626 -0.671 . . . . 1.89 109.416 -179.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 31.7 mm -129.17 140.07 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.622 -0.674 . . . . 1.03 109.967 179.97 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 63.3 m -96.75 124.35 40.71 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.163 -1.421 . . . . 0.19 107.163 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -77.61 141.57 39.41 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.845 -1.159 . . . . 0.93 110.908 -178.608 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.455 ' C ' ' H ' ' B' ' 69' ' ' VAL . 20.2 m95 -76.56 -10.01 59.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.005 -1.059 . . . . 0.21 108.508 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -53.43 -11.76 0.36 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.577 -0.897 . . . . 0.49 108.577 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.455 ' H ' ' C ' ' B' ' 67' ' ' TRP . 16.5 m -61.32 144.46 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.38 -0.825 . . . . 1.66 109.114 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -59.03 -40.03 83.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.16 -0.962 . . . . 1.36 109.247 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 109.446 -1.461 . . . . 2.32 109.446 179.931 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.492 1.67 0 N-CA-C 109.306 -0.627 . . . . 3.32 109.306 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 93.5 t -99.2 131.6 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.205 -0.934 . . . . 1.16 108.605 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.8 tptt -130.02 129.18 43.37 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.269 -1.011 . . . . 2.18 108.269 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -98.01 123.7 42.14 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.331 -0.989 . . . . 0.4 108.331 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.0 mm -101.56 112.79 35.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.186 -0.946 . . . . 1.04 108.508 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.444 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 50.4 mp0 -95.87 -1.26 49.78 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.313 -0.867 . . . . 2.25 109.392 -179.057 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -153.98 154.8 34.41 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.947 -1.096 . . . . 0.91 111.439 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.9 ttpp -63.38 -31.16 72.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.98 -1.119 . . . . 2.18 107.98 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.8 m -59.05 -46.65 87.7 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.934 -0.765 . . . . 1.03 108.934 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 -30.02 66.4 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.288 -0.883 . . . . 1.02 108.692 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.6 t80 -59.45 -43.83 93.08 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.119 -0.988 . . . . 0.15 109.321 -179.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -63.68 -41.98 98.09 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 119.634 -0.827 . . . . 2.07 108.796 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -64.94 -39.87 94.17 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.666 -0.646 . . . . 1.77 110.483 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -41.24 94.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.308 -0.87 . . . . 1.04 108.966 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 39.6 mt -61.23 -40.17 93.01 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.112 -0.993 . . . . 1.07 108.734 179.463 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.28 -34.55 72.91 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.965 -0.694 . . . . 1.07 109.698 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.03 80.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.362 -0.836 . . . . 1.07 110.298 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.23 70.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.069 -1.02 . . . . 1.03 109.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.81 -124.57 21.07 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.144 -1.582 . . . . 0.24 109.144 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -91.97 0.46 57.47 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -1.085 . . . . 1.07 110.336 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -75.72 149.89 37.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.996 -1.065 . . . . 2.03 109.345 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 11.1 mt -55.81 160.58 2.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.019 -1.051 . . . . 1.23 110.213 -179.866 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.1 t -148.62 108.35 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 107.995 -1.113 . . . . 1.03 107.995 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.3 t -100.95 140.8 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 107.606 -1.257 . . . . 1.03 107.606 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -124.63 124.5 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.186 -0.946 . . . . 1.01 109.748 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -101.09 116.96 34.05 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.431 -0.793 . . . . 1.05 110.022 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -91.95 22.53 4.22 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.73 110.265 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -54.52 144.42 21.38 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.666 -1.271 . . . . 0.84 110.667 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.99 127.97 33.17 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.084 -1.45 . . . . 1.04 107.084 178.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -67.94 -31.32 70.99 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.832 -1.147 . . . . 1.08 108.527 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.503 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 69.7 p-90 -76.53 -13.53 60.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.342 -0.849 . . . . 0.29 111.467 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.3 t -87.98 114.27 24.44 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.679 -1.263 . . . . 0.26 108.592 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.463 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.25 -51.94 54.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.647 -0.981 . . . . 0.28 110.647 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.463 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 32.9 Cg_exo -50.44 -38.04 52.65 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 CA-C-N 118.463 1.132 . . . . 0.5 112.183 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.99 -43.74 23.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 1.04 109.66 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -59.96 -32.13 70.53 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.986 -1.071 . . . . 2.12 108.819 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 54.5 ttm -60.41 -29.28 68.87 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 2.66 109.828 -179.91 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 17.1 mt -80.29 -4.21 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.934 -0.479 . . . . 1.22 110.997 -179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.69 -30.93 7.11 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 119.823 -1.798 . . . . 1.44 113.724 -177.727 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.3 Cg_exo -59.5 -36.42 93.33 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 CA-C-N 121.586 1.602 . . . . 0.31 112.0 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -72.41 -51.63 19.52 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 118.686 -1.206 . . . . 0.45 108.874 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -59.61 -48.28 82.27 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.892 -0.781 . . . . 0.16 108.892 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -68.18 -42.46 79.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.298 -0.876 . . . . 0.35 110.812 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.3 m -64.52 -37.09 86.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.927 -1.108 . . . . 0.77 110.771 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.8 -22.78 66.87 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.125 -0.984 . . . . 1.07 110.525 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -53.57 -37.14 62.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.766 -1.209 . . . . 0.87 107.903 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -87.85 -15.34 37.05 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.556 -0.715 . . . . 2.16 109.501 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -76.69 -38.26 54.73 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.254 -1.387 . . . . 2.29 107.254 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -123.66 69.37 1.04 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.183 -1.414 . . . . 0.95 107.183 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.3 p -64.18 -8.98 14.17 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.012 -0.736 . . . . 0.89 109.012 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -89.07 8.54 29.3 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.621 -0.881 . . . . 1.13 108.621 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.36 146.46 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.059 -1.089 . . . . 1.06 108.059 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.1 mm -99.79 119.75 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 120.997 -1.064 . . . . 1.04 109.828 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -101.15 127.85 47.52 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.273 -0.892 . . . . 0.13 109.98 179.619 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.456 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.7 mp -110.75 143.0 41.95 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.229 -0.919 . . . . 1.08 110.13 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -113.53 129.66 56.51 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 106.973 -1.492 . . . . 1.13 106.973 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.5 t -127.97 132.0 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.152 -0.968 . . . . 1.03 110.914 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.2 t0 -93.74 119.88 33.29 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.815 -0.809 . . . . 1.05 108.815 179.132 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.19 -17.33 22.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 120.672 -1.267 . . . . 1.04 107.797 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.503 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.18 -43.97 9.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 1.08 111.527 -178.924 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -94.41 -14.99 24.7 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.649 -1.282 . . . . 1.07 108.573 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.02 37.62 4.37 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.966 -1.124 . . . . 1.03 107.966 179.761 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.57 -18.14 38.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.8 -0.563 . . . . 1.92 110.668 -178.398 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 1.3 p30 -66.36 -43.08 87.02 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.838 -1.164 . . . . 1.05 108.719 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.2 t -68.72 -44.62 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.469 -0.769 . . . . 1.1 110.056 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.25 -39.08 75.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.426 -0.796 . . . . 1.03 110.663 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -62.62 -32.79 73.87 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.942 -1.099 . . . . 0.89 109.154 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.05 -39.86 95.02 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.494 -0.754 . . . . 2.06 109.617 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.33 2.03 51.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -0.932 . . . . 1.05 110.476 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 53.14 51.55 15.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.322 -0.861 . . . . 2.02 108.788 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.5 t -63.97 131.14 29.55 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 C-N-CA 118.517 -1.273 . . . . 1.05 108.391 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -103.77 -11.38 17.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.679 -0.638 . . . . 2.16 110.707 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.7 154.87 18.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.709 -1.245 . . . . 1.04 111.167 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -126.34 154.53 74.77 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.359 -0.978 . . . . 1.04 108.359 178.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.35 143.69 75.54 Favored 'Cis proline' 0 N--CA 1.494 1.518 0 C-N-CA 123.829 -1.321 . . . . 0.19 112.615 -2.867 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 86.0 m -129.66 131.19 46.32 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.556 0.693 . . . . 1.04 109.305 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -108.59 132.76 53.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.6 -0.687 . . . . 0.23 109.221 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -122.72 141.07 52.18 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.506 -0.924 . . . . 0.43 108.506 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -108.51 133.9 52.03 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.741 -0.599 . . . . 0.17 110.167 -179.2 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -124.56 147.26 48.54 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.502 0.668 . . . . 0.17 109.837 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -144.99 128.58 17.1 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.87 -1.159 . . . . 2.18 107.87 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 49.69 38.78 16.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.116 -0.99 . . . . 1.8 108.335 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.73 24.29 76.38 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.796 -1.192 . . . . 0.23 110.169 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -128.37 135.12 49.11 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.333 -1.098 . . . . 2.75 110.339 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -79.46 127.38 32.05 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.035 -1.04 . . . . 2.3 109.312 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.9 m -124.19 5.59 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.71 -0.619 . . . . 1.06 110.692 -179.653 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.82 154.22 13.89 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 118.465 -1.826 . . . . 0.22 111.476 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.7 tm-20 -164.88 149.71 9.39 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.788 -0.83 . . . . 1.93 109.305 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.439 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 15.1 p90 -163.18 160.97 24.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.192 -1.003 . . . . 0.16 109.524 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.73 159.99 30.9 Favored 'General case' 0 N--CA 1.5 2.053 0 CA-C-O 121.388 0.614 . . . . 0.9 109.71 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.88 142.14 6.09 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 108.933 -1.667 . . . . 0.12 108.933 179.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.09 66.01 4.42 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.217 -1.167 . . . . 1.04 109.94 -179.484 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.6 t-20 -119.64 99.89 6.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.351 -0.843 . . . . 1.36 109.306 178.647 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.47 -33.51 74.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.341 -0.849 . . . . 1.6 111.672 -179.825 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.22 -27.13 67.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.438 -1.414 . . . . 1.61 109.376 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 22.5 ttmt -61.13 -37.75 83.93 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.144 -1.058 . . . . 2.02 108.144 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.5 mt -58.63 -39.6 80.99 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 122.056 0.931 . . . . 1.05 108.5 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -61.53 -43.22 99.25 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.21 -0.596 . . . . 2.1 111.005 -178.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.53 -43.99 71.9 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.094 -1.004 . . . . 1.06 112.08 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.99 -39.23 93.16 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.798 -1.189 . . . . 1.04 110.172 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.98 -49.57 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.097 -1.002 . . . . 1.04 108.377 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.8 t-20 -60.91 -35.76 77.52 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.589 -0.893 . . . . 1.09 108.589 179.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . 0.423 ' O ' ' OE2' ' A' ' 103' ' ' GLU . 2.5 tm-20 -68.25 -39.1 82.35 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.695 -0.628 . . . . 2.21 110.166 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.91 -6.5 28.77 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.002 -1.061 . . . . 1.05 111.534 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.408 ' O ' ' CG1' ' A' ' 105' ' ' VAL . 7.9 p . . . . . 0 N--CA 1.501 2.101 0 O-C-N 120.441 -1.412 . . . . 1.08 109.657 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.496 1.657 0 CA-C-O 121.206 0.419 . . . . 1.75 112.377 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.2 124.98 39.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.199 -0.938 . . . . 1.35 108.84 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.456 ' O ' ' O ' ' B' ' 64' ' ' ILE . 21.3 m -107.33 129.98 54.83 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.347 -0.845 . . . . 1.36 109.18 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.77 -29.21 68.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.276 -0.89 . . . . 1.24 109.018 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt -64.4 -19.59 65.6 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.352 -0.843 . . . . 1.89 108.765 -179.328 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.456 ' O ' ' O ' ' B' ' 61' ' ' THR . 29.4 mm -130.07 140.32 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.794 -0.566 . . . . 1.03 109.571 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -99.83 129.83 45.97 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 106.759 -1.571 . . . . 0.19 106.759 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.1 m -81.46 138.4 35.52 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.535 -1.353 . . . . 0.93 111.321 -178.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.44 ' C ' ' H ' ' B' ' 69' ' ' VAL . 19.2 m95 -72.11 -9.79 58.9 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.064 -1.022 . . . . 0.21 109.572 178.845 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -52.91 -12.32 0.31 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.49 109.272 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.44 ' H ' ' C ' ' B' ' 67' ' ' TRP . 10.8 m -57.68 139.31 17.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 O-C-N 121.319 -0.863 . . . . 1.66 109.264 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -59.77 -39.17 83.94 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 120.874 -1.141 . . . . 1.36 109.529 -179.466 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 CA-C-O 118.18 -1.345 . . . . 2.32 110.248 -179.581 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.5 tpt . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.178 -0.675 . . . . 3.32 109.178 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.6 t -98.71 159.22 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.464 -0.773 . . . . 1.16 109.465 -179.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 80.2 tttt -129.88 124.44 33.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.414 -0.804 . . . . 2.18 108.885 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -94.3 124.12 38.12 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.359 -0.978 . . . . 0.4 108.359 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -100.16 112.85 33.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 108.478 -0.934 . . . . 1.04 108.478 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.454 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -97.39 -0.26 46.61 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.063 -1.023 . . . . 2.25 109.652 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -155.16 159.15 39.94 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.993 -1.067 . . . . 0.91 111.216 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -63.5 -32.34 73.76 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.073 -1.084 . . . . 2.18 108.073 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.432 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 88.1 m -57.76 -48.35 79.9 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.665 -0.814 . . . . 1.03 108.813 -179.326 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -30.86 69.45 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.259 -0.901 . . . . 1.02 108.715 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -59.33 -43.87 92.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.149 -0.969 . . . . 0.15 109.06 -179.57 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -66.35 -42.99 87.27 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 120.046 -0.662 . . . . 2.07 109.449 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -65.12 -39.94 93.79 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.69 -0.631 . . . . 1.77 110.328 179.629 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.73 88.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.081 -1.012 . . . . 1.04 109.446 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.8 mt -60.71 -39.94 90.42 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.162 -1.051 . . . . 1.07 108.162 179.329 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -69.84 -36.96 75.99 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.674 -0.641 . . . . 1.07 110.205 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.76 -37.48 82.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.51 -0.744 . . . . 1.07 109.926 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.07 72.93 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.871 . . . . 1.03 109.649 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -125.87 24.67 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 110.015 -1.234 . . . . 0.24 110.015 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -92.02 5.9 48.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.107 -1.231 . . . . 1.07 110.203 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -76.39 149.36 36.93 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.838 -1.164 . . . . 2.03 109.472 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.46 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.05 155.53 16.78 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.523 -1.288 . . . . 1.23 107.523 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.46 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 64.7 t -143.22 111.54 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 O-C-N 120.919 -1.113 . . . . 1.03 109.059 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.0 t -100.65 141.88 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 107.91 -1.145 . . . . 1.03 107.91 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.06 124.31 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.341 -0.85 . . . . 1.01 109.443 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.5 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.637 -0.664 . . . . 1.05 110.144 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -95.91 23.17 6.58 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.348 -0.845 . . . . 0.73 109.95 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.5 m -59.02 145.25 42.58 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.844 -1.16 . . . . 0.84 110.385 -178.485 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.05 126.81 33.42 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.547 -1.279 . . . . 1.04 107.547 179.039 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -68.27 -28.31 67.09 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 118.848 -1.141 . . . . 1.08 108.781 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.541 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 60.8 p-90 -77.42 -19.22 56.4 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.079 -1.013 . . . . 0.29 110.072 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.2 t -83.84 122.45 28.71 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.167 -1.049 . . . . 0.26 108.167 -179.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.461 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.6 -54.08 34.11 Favored Glycine 0 N--CA 1.488 2.113 0 C-N-CA 120.728 -0.749 . . . . 0.28 111.977 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.461 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.3 Cg_endo -59.53 -31.04 93.93 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 CA-C-N 119.588 1.694 . . . . 0.5 112.404 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.69 -55.48 5.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.036 -1.04 . . . . 1.04 109.805 179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -60.16 -38.43 83.15 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.942 -1.099 . . . . 2.12 110.25 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.33 -28.79 67.14 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.088 -1.008 . . . . 2.66 109.677 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.437 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 65.8 mt -83.36 -3.86 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.751 -0.593 . . . . 1.22 111.312 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.4 ptmt -66.67 -29.83 3.0 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 120.262 -1.524 . . . . 1.44 113.468 -177.372 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -54.74 -39.83 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.759 1.664 . . . . 0.31 112.409 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 32.4 m-85 -68.74 -44.05 74.61 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 118.187 -1.405 . . . . 0.45 108.134 179.487 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -60.34 -54.18 48.77 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.33 -0.856 . . . . 0.16 109.533 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.3 t60 -66.98 -39.92 87.29 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.82 -0.55 . . . . 0.35 110.554 -179.593 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.439 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.7 m -61.47 -37.79 84.91 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.87 -1.144 . . . . 0.77 110.286 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.3 mt -60.99 -23.6 65.49 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.334 -0.854 . . . . 1.07 110.298 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -54.79 -38.94 67.91 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.069 -1.02 . . . . 0.87 108.915 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.8 mp0 -87.87 -13.51 41.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 2.16 109.733 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -80.34 -37.49 32.42 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 105.76 -1.941 . . . . 2.29 105.76 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -123.1 66.75 0.98 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.199 -1.408 . . . . 0.95 107.199 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.3 p -62.33 -8.32 5.73 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.952 -0.759 . . . . 0.89 108.952 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -91.03 9.72 29.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.737 -0.838 . . . . 1.13 108.737 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.5 t -129.3 147.01 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 N-CA-C 108.169 -1.048 . . . . 1.06 108.169 178.771 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.8 120.1 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 120.961 -1.087 . . . . 1.04 110.165 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 29.3 m-85 -102.28 127.84 49.08 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.985 -1.072 . . . . 0.13 109.348 179.352 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 1.9 mp -110.02 140.3 44.19 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.245 -0.909 . . . . 1.08 109.389 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -110.4 129.52 55.74 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.69 -1.596 . . . . 1.13 106.69 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.67 129.87 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 121.555 0.693 . . . . 1.03 110.252 -178.188 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.418 ' O ' ' N ' ' A' ' 62' ' ' ALA . 55.7 t0 -93.24 119.58 32.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.333 -0.988 . . . . 1.05 108.333 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -67.29 -20.46 26.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 C-N-CA 118.301 -1.36 . . . . 1.04 108.186 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.541 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.39 -42.12 10.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.433 -0.792 . . . . 1.08 111.696 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 22.0 m-20 -96.18 -13.86 23.2 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.688 -1.257 . . . . 1.07 108.412 179.643 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.418 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -126.06 40.05 3.81 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.703 -1.221 . . . . 1.03 107.703 179.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -59.86 -24.81 64.53 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.841 -0.537 . . . . 1.92 109.969 -178.618 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.517 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.52 -39.36 91.71 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.79 -1.194 . . . . 1.05 109.497 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.517 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 15.2 t -69.92 -44.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.133 -0.979 . . . . 1.1 109.669 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -36.52 66.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.681 -0.637 . . . . 1.03 110.847 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.8 p -60.55 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.89 109.573 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.3 -37.08 85.85 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.292 -0.88 . . . . 2.06 109.537 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.13 -0.15 53.59 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 1.05 111.04 -178.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.2 mp0 54.38 49.41 18.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.984 -1.073 . . . . 2.02 109.845 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.85 134.35 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 120.833 -1.167 . . . . 1.05 108.763 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -106.43 -12.48 15.63 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.527 -0.733 . . . . 2.16 110.474 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.26 153.37 19.86 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.836 -1.165 . . . . 1.04 110.562 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -125.2 155.65 70.88 Favored Pre-proline 0 N--CA 1.499 2.016 0 N-CA-C 107.861 -1.163 . . . . 1.04 107.861 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -76.35 145.09 81.22 Favored 'Cis proline' 0 N--CA 1.491 1.341 0 C-N-CA 123.724 -1.365 . . . . 0.19 112.514 -2.459 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.7 m -129.45 132.2 46.91 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 108.735 -0.839 . . . . 1.04 108.735 178.443 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.5 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.0 m-85 -110.16 130.76 55.49 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 109.109 -0.7 . . . . 0.23 109.109 -179.191 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -122.82 139.34 54.12 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.739 -0.838 . . . . 0.43 108.739 179.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -106.83 132.06 53.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.356 0.598 . . . . 0.17 110.197 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -125.94 147.75 49.42 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.181 -0.674 . . . . 0.17 109.181 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -147.18 125.54 12.32 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.483 -1.303 . . . . 2.18 107.483 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.1 mttt 59.58 28.22 17.58 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.195 -1.409 . . . . 1.8 107.195 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.415 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 76.34 16.24 80.86 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.996 -1.242 . . . . 0.23 109.996 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.415 HE21 ' C ' ' A' ' 83' ' ' GLY . 7.0 mm-40 -115.57 132.94 56.47 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.472 -1.016 . . . . 2.75 110.467 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -77.14 124.22 27.5 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 107.896 -1.15 . . . . 2.3 107.896 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.8 m -123.52 11.88 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.696 -0.627 . . . . 1.06 110.06 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.23 156.03 15.08 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 118.909 -1.615 . . . . 0.22 111.251 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -166.4 148.0 6.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.886 -0.773 . . . . 1.93 109.223 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.596 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 7.1 p90 -164.47 159.04 18.99 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 119.828 -0.749 . . . . 0.16 109.523 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.67 161.39 28.19 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.558 0.694 . . . . 0.9 110.022 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.98 142.1 5.93 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.519 -1.433 . . . . 0.12 109.519 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.26 65.06 2.78 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -1.094 . . . . 1.04 109.721 -179.556 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -120.04 90.82 3.4 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.398 -0.964 . . . . 1.36 108.398 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.409 ' CD ' ' H ' ' A' ' 94' ' ' LYS . 0.2 OUTLIER -64.47 -35.13 79.95 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.068 -1.02 . . . . 1.6 111.546 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -62.04 -30.06 70.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.798 -1.189 . . . . 1.61 109.969 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.596 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 58.3 tttm -61.46 -32.91 72.91 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.669 0.747 . . . . 2.02 109.314 -179.183 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.0 mt -59.62 -39.68 85.04 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.215 -1.031 . . . . 1.05 108.215 179.408 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.47 -41.36 97.12 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 120.073 -0.651 . . . . 2.1 110.547 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.82 -43.45 75.54 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.087 -1.008 . . . . 1.06 111.698 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.8 m -67.3 -36.09 80.81 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.757 -1.214 . . . . 1.04 109.949 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.7 -50.11 79.34 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.061 -1.024 . . . . 1.04 108.35 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -60.03 -34.47 73.42 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.256 -1.016 . . . . 1.09 108.256 179.266 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.07 -39.97 82.82 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.752 -0.592 . . . . 2.21 110.406 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 94.8 mt -98.95 -2.99 36.07 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.218 -0.926 . . . . 1.05 111.293 -179.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.2 p . . . . . 0 N--CA 1.496 1.87 0 O-C-N 120.413 -1.43 . . . . 1.08 109.11 -179.535 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo . . . . . 0 N--CA 1.493 1.459 0 CA-C-O 120.899 0.291 . . . . 1.75 112.424 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.09 124.14 36.85 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.098 -1.001 . . . . 1.35 108.809 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 28.5 m -100.07 129.88 46.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.29 -0.881 . . . . 1.36 109.749 -179.49 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 83.3 mt -68.15 -30.66 69.84 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.498 -0.751 . . . . 1.24 109.782 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt -61.17 -16.83 48.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.499 -0.751 . . . . 1.89 109.674 -179.001 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.7 mm -129.02 140.11 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 N-CA-C 109.259 -0.645 . . . . 1.03 109.259 -179.731 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.0 m -98.29 131.55 44.52 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 107.272 -1.381 . . . . 0.19 107.272 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -81.46 140.12 34.8 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.614 -1.304 . . . . 0.93 111.29 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.474 ' C ' ' H ' ' B' ' 69' ' ' VAL . 25.1 m95 -74.22 -10.1 59.27 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.203 -0.936 . . . . 0.21 109.697 179.021 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . 0.416 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.9 m120 -52.0 -12.03 0.2 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.008 -1.057 . . . . 0.49 108.76 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.474 ' H ' ' C ' ' B' ' 67' ' ' TRP . 17.3 m -63.48 143.8 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 1.66 109.27 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.57 -37.92 79.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.159 -0.963 . . . . 1.36 109.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.027 0 N-CA-C 109.128 -1.589 . . . . 2.32 109.128 -179.418 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.413 ' SD ' ' OE2' ' A' ' 47' ' ' GLU . 36.0 mmt . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 108.689 -0.856 . . . . 3.32 108.689 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.5 t -99.82 136.5 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.24 -0.913 . . . . 1.16 109.515 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -129.89 126.31 37.64 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.122 -1.066 . . . . 2.18 108.122 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -97.13 123.24 40.84 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.339 -0.986 . . . . 0.4 108.339 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.0 mm -100.3 112.8 34.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.774 -0.824 . . . . 1.04 108.774 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.4 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -94.63 -2.01 52.15 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 120.916 -1.115 . . . . 2.25 110.203 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -152.21 154.08 35.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.659 -1.275 . . . . 0.91 110.801 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -63.45 -32.42 73.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.258 -1.016 . . . . 2.18 108.258 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.6 m -57.89 -46.73 84.48 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.285 -0.966 . . . . 1.03 108.651 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.12 -29.53 67.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.412 -0.805 . . . . 1.02 108.992 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.6 t80 -59.85 -44.09 94.31 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.479 -0.934 . . . . 0.15 108.479 -179.911 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.32 -43.64 94.03 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.016 -0.735 . . . . 2.07 109.016 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -64.29 -35.8 82.03 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.376 0.608 . . . . 1.77 109.819 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.04 -41.67 81.7 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.271 -0.893 . . . . 1.04 109.045 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.6 mt -61.0 -41.22 96.09 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.104 -1.038 . . . . 1.07 108.668 -179.855 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -69.5 -39.28 77.68 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.399 -0.813 . . . . 1.07 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.36 80.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.257 -0.902 . . . . 1.07 110.405 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.82 -28.62 69.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.162 -0.961 . . . . 1.03 110.257 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.02 -130.7 30.33 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.045 -1.222 . . . . 0.24 110.045 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -89.97 2.47 55.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.124 -1.221 . . . . 1.07 110.698 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -76.73 150.44 36.26 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.902 -1.124 . . . . 2.03 109.474 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 12.2 mt -57.97 158.64 6.42 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.106 -0.996 . . . . 1.23 111.011 179.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.1 t -147.06 108.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.432 -0.951 . . . . 1.03 108.432 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 58.7 t -101.48 143.53 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.227 -1.397 . . . . 1.03 107.227 179.457 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -125.18 123.24 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.319 -0.863 . . . . 1.01 110.139 -178.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.522 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.16 123.57 42.28 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.006 -0.738 . . . . 1.05 109.006 179.105 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.72 24.34 8.46 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.997 -1.065 . . . . 0.73 109.601 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.408 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 46.8 m -58.47 147.9 30.14 Favored 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.09 -1.006 . . . . 0.84 110.498 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.44 127.29 34.34 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 107.422 -1.325 . . . . 1.04 107.422 178.96 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.2 t -66.93 -30.92 71.19 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.695 -1.202 . . . . 1.08 108.949 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.535 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 64.0 p-90 -76.61 -16.48 59.56 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.09 -1.006 . . . . 0.29 111.565 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -86.38 114.0 22.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.616 -1.302 . . . . 0.26 108.408 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.448 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.98 -51.37 59.3 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 120.317 -0.944 . . . . 0.28 111.232 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.448 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 32.8 Cg_exo -50.44 -37.6 51.71 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 CA-C-N 118.96 1.38 . . . . 0.5 112.396 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.85 -44.17 28.08 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.272 -0.893 . . . . 1.04 109.331 179.807 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -59.85 -32.02 70.29 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.534 -0.913 . . . . 2.12 108.534 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.8 ttt -60.14 -29.3 68.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.582 -0.699 . . . . 2.66 109.797 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 8.6 mt -83.01 -4.65 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.512 -0.743 . . . . 1.22 110.833 -179.525 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.535 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.18 -32.45 10.83 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 119.701 -1.874 . . . . 1.44 113.131 -176.986 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.7 Cg_exo -58.82 -36.53 96.86 Favored 'Trans proline' 0 N--CA 1.493 1.446 0 CA-C-N 121.675 1.634 . . . . 0.31 112.046 -178.226 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.41 -51.88 18.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.822 -1.174 . . . . 0.45 109.007 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.37 -46.85 87.5 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.155 0.979 . . . . 0.16 108.744 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -68.07 -46.88 69.82 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 115.918 -0.583 . . . . 0.35 110.866 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.464 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 72.8 m -60.88 -38.87 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.091 -1.005 . . . . 0.77 110.343 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.32 -24.52 66.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.263 -0.898 . . . . 1.07 111.07 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.4 m -54.1 -37.75 64.62 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.659 -1.275 . . . . 0.87 108.109 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE2' ' SD ' ' A' ' 1' ' ' MET . 73.0 mm-40 -85.44 -18.22 34.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.917 -1.114 . . . . 2.16 109.789 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -74.84 -37.03 62.35 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.052 -1.462 . . . . 2.29 107.052 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -122.99 68.07 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 107.243 -1.391 . . . . 0.95 107.243 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.6 p -64.7 -8.71 15.7 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.97 -0.752 . . . . 0.89 108.97 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -91.66 6.72 44.72 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 1.13 108.385 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.4 t -126.02 146.02 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 107.73 -1.211 . . . . 1.06 107.73 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.2 mm -99.1 124.88 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.132 -0.98 . . . . 1.04 109.73 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 47.1 m-85 -107.09 127.74 53.75 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.288 -0.882 . . . . 0.13 109.529 179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.431 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.3 mp -110.93 140.21 45.62 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.047 -1.033 . . . . 1.08 110.056 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -109.77 129.89 55.57 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.52 -1.659 . . . . 1.13 106.52 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.6 t -125.37 135.09 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.193 -0.942 . . . . 1.03 110.109 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.5 t0 -98.19 117.44 32.57 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.745 -0.835 . . . . 1.05 108.745 179.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.5 m -65.01 -19.47 25.72 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 120.526 -1.359 . . . . 1.04 108.19 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.19 -41.19 11.13 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 1.08 111.949 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -97.49 -18.36 19.06 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.611 -1.306 . . . . 1.07 108.826 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.31 39.1 3.8 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 107.925 -1.139 . . . . 1.03 107.925 179.312 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -60.06 -19.56 53.59 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.745 -0.597 . . . . 1.92 109.702 -178.742 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.485 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -63.55 -35.76 81.54 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.894 -1.129 . . . . 1.05 109.066 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.485 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 13.2 t -73.4 -41.31 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.067 -1.021 . . . . 1.1 108.951 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.69 -41.91 78.52 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.64 -0.663 . . . . 1.03 110.638 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.0 p -60.01 -39.14 84.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.842 -1.161 . . . . 0.89 108.847 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -65.79 -40.06 91.59 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.352 -0.842 . . . . 2.06 109.465 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.61 -3.9 58.96 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.203 -0.935 . . . . 1.05 111.388 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 53.35 49.67 19.21 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.834 -1.166 . . . . 2.02 110.476 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.08 132.83 32.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 O-C-N 120.602 -1.311 . . . . 1.05 108.52 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -103.68 -12.16 17.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.396 -0.815 . . . . 2.16 110.67 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.468 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -158.4 155.36 28.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.709 -1.245 . . . . 1.04 110.905 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.8 154.58 81.06 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 108.007 -1.108 . . . . 1.04 108.007 179.211 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -77.04 141.92 70.8 Favored 'Cis proline' 0 N--CA 1.49 1.309 0 C-N-CA 123.666 -1.389 . . . . 0.19 112.462 -2.755 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.8 m -125.95 136.13 52.65 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.659 -0.867 . . . . 1.04 108.659 178.411 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.522 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.9 m-85 -111.75 132.95 54.31 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.505 -0.924 . . . . 0.23 108.505 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -123.83 143.23 50.46 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.661 -0.866 . . . . 0.43 108.661 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 59.4 m-85 -108.65 129.74 55.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.468 0.651 . . . . 0.17 110.722 -179.277 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -124.15 142.26 51.37 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.86 -0.793 . . . . 0.17 108.86 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -146.44 127.05 14.2 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.531 -1.285 . . . . 2.18 107.531 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.8 mttt 60.07 28.88 18.48 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.433 -0.792 . . . . 1.8 109.282 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.94 14.42 82.02 Favored Glycine 0 N--CA 1.495 2.63 0 O-C-N 120.857 -1.152 . . . . 0.23 110.664 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -124.11 144.3 49.96 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.335 -1.097 . . . . 2.75 110.877 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -81.92 126.71 32.23 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.593 -0.692 . . . . 2.3 109.16 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.67 9.58 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.617 -0.677 . . . . 1.06 110.707 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.23 162.56 28.69 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 118.239 -1.934 . . . . 0.22 111.471 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -168.42 148.05 4.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.97 -0.752 . . . . 1.93 108.97 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.485 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 4.1 p90 -167.78 156.01 9.07 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.197 -0.94 . . . . 0.16 109.664 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.9 p -126.34 160.0 31.61 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.563 -0.71 . . . . 0.9 109.997 -179.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.14 141.51 5.78 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.471 -1.452 . . . . 0.12 109.471 179.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.16 65.41 2.13 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.288 -1.125 . . . . 1.04 110.056 -179.81 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.52 97.71 5.78 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.642 -0.873 . . . . 1.36 108.642 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -32.47 71.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.069 -1.019 . . . . 1.6 111.732 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -64.25 -30.05 71.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.082 -1.011 . . . . 1.61 109.321 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -60.42 -35.47 75.86 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.301 -0.629 . . . . 2.02 109.301 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 55.0 mt -59.79 -39.87 86.41 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.145 0.974 . . . . 1.05 108.797 179.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -63.24 -40.43 97.41 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.967 -0.693 . . . . 2.1 110.755 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -44.3 72.45 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.078 -1.013 . . . . 1.06 111.754 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.0 m -67.11 -38.55 85.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.771 -1.205 . . . . 1.04 109.819 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.7 mt -60.91 -49.93 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.187 -0.946 . . . . 1.04 108.494 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.01 -36.38 77.08 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 122.055 0.931 . . . . 1.09 109.074 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -67.2 -40.16 86.45 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.732 -0.605 . . . . 2.21 110.38 -178.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.3 mt -99.36 -4.7 31.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.12 -0.988 . . . . 1.05 111.225 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.497 1.901 0 O-C-N 120.207 -1.558 . . . . 1.08 109.366 -178.71 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo . . . . . 0 N--CA 1.493 1.468 0 CA-C-O 121.002 0.334 . . . . 1.75 112.605 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.1 124.38 33.18 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.848 -1.158 . . . . 1.35 108.937 179.243 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 24.8 m -109.96 129.9 55.6 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.298 -0.876 . . . . 1.36 109.153 179.997 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -63.83 -30.38 71.48 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.221 -0.924 . . . . 1.24 109.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm -59.49 -27.02 65.76 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.524 -0.735 . . . . 1.89 109.458 -179.275 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.8 mm -128.9 141.57 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.896 -0.503 . . . . 1.03 110.169 -179.119 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.5 m -101.21 128.25 47.42 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.799 -1.556 . . . . 0.19 106.799 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.9 m -79.84 141.1 36.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.759 -1.213 . . . . 0.93 110.442 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.468 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.2 m95 -74.47 -12.23 60.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.217 -0.927 . . . . 0.21 109.316 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.29 -12.1 0.13 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.145 -0.972 . . . . 0.49 108.919 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.466 ' H ' ' C ' ' B' ' 67' ' ' TRP . 15.6 m -60.28 141.81 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.937 . . . . 1.66 109.739 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -59.87 -37.52 79.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.135 -0.978 . . . . 1.36 109.462 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.909 -1.495 . . . . 2.32 109.761 -179.813 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.0 tpp . . . . . 0 N--CA 1.493 1.695 0 N-CA-C 109.46 -0.571 . . . . 3.32 109.46 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.443 ' CG1' ' N ' ' A' ' 3' ' ' LYS . 53.9 t -98.75 163.98 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.493 -0.755 . . . . 1.16 109.153 179.585 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.443 ' N ' ' CG1' ' A' ' 2' ' ' VAL . 48.3 tptt -130.8 129.89 42.98 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.486 -0.931 . . . . 2.18 108.486 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.41 125.1 41.84 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.227 -0.921 . . . . 0.4 108.829 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.9 mm -103.03 113.6 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 108.382 -0.97 . . . . 1.04 108.382 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -96.88 -0.64 47.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.011 -1.056 . . . . 2.25 109.843 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -154.7 156.53 36.56 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.014 -1.054 . . . . 0.91 110.802 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -63.62 -31.95 73.27 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.289 -1.004 . . . . 2.18 108.289 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.451 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 59.3 m -57.15 -48.21 79.25 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.403 -0.919 . . . . 1.03 108.826 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.36 -28.82 66.54 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.205 -0.934 . . . . 1.02 108.959 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -59.9 -43.94 94.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.323 -0.861 . . . . 0.15 109.272 -179.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -65.59 -42.55 91.57 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.823 -0.751 . . . . 2.07 109.052 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.55 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.67 -40.05 95.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 1.77 110.394 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.24 90.86 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.137 -0.977 . . . . 1.04 109.239 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.222 -1.029 . . . . 1.07 108.222 179.828 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -70.07 -35.31 74.13 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.926 -0.71 . . . . 1.07 110.127 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.05 -36.65 77.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.095 -1.003 . . . . 1.07 110.001 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.32 -34.76 77.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.918 -1.114 . . . . 1.03 109.507 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.37 -124.52 19.2 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 110.125 -1.19 . . . . 0.24 110.125 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -91.92 5.2 50.97 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.943 -1.328 . . . . 1.07 110.307 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -77.29 149.33 35.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.004 -1.06 . . . . 2.03 109.021 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.455 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.2 156.49 18.31 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.614 -1.254 . . . . 1.23 107.614 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.455 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 84.5 t -143.78 113.04 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.807 -1.183 . . . . 1.03 109.205 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.3 t -101.22 142.39 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.392 -0.966 . . . . 1.03 108.392 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -125.42 121.96 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.218 -0.926 . . . . 1.01 109.582 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -98.82 120.9 40.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.355 -0.841 . . . . 1.05 110.346 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -95.94 24.43 5.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.73 109.49 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -59.22 145.79 41.53 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.154 -0.966 . . . . 0.84 110.545 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.21 123.3 31.33 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.406 -0.961 . . . . 1.04 108.406 179.478 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.91 -30.96 70.42 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.91 -1.144 . . . . 1.08 107.91 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.527 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 55.8 p-90 -71.38 -26.38 62.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.373 -0.829 . . . . 0.29 110.6 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.27 123.68 29.83 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.803 -1.186 . . . . 0.26 107.967 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.423 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.08 -53.07 32.06 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.506 -0.854 . . . . 0.28 111.534 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.4 Cg_exo -51.55 -31.96 41.9 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 CA-C-N 118.704 1.252 . . . . 0.5 112.095 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.38 -50.67 10.48 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.377 -0.827 . . . . 1.04 109.725 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.67 -39.27 83.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.282 -0.887 . . . . 2.12 109.468 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.3 ttm -57.6 -27.7 62.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.474 -0.766 . . . . 2.66 109.622 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 66.3 mt -85.29 -2.99 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 1.22 111.374 -178.839 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.35 -30.13 6.22 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 120.447 -1.408 . . . . 1.44 113.454 -179.289 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 33.8 Cg_exo -59.28 -41.62 57.47 Favored 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 121.52 1.578 . . . . 0.31 113.642 -176.91 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.98 -45.27 74.59 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 117.589 -1.644 . . . . 0.45 107.771 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -59.69 -54.37 47.14 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.202 -0.936 . . . . 0.16 110.239 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -68.24 -40.0 82.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.546 -0.721 . . . . 0.35 110.866 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.5 m -61.18 -39.03 88.61 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.823 -1.173 . . . . 0.77 110.755 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -61.93 -22.51 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.143 -0.973 . . . . 1.07 110.901 -178.723 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.9 m -54.12 -35.45 62.2 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 120.82 -1.175 . . . . 0.87 108.457 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -88.26 -14.78 37.55 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.485 -0.759 . . . . 2.16 108.961 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.34 -36.21 39.8 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 106.955 -1.498 . . . . 2.29 106.955 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.413 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 78.0 m-85 -124.82 68.83 1.1 Allowed 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.29 -1.374 . . . . 0.95 107.29 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 71.7 p -65.11 -8.5 16.97 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.496 -0.752 . . . . 0.89 109.188 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -89.02 6.09 41.34 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 41.6 t -126.09 145.56 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 107.441 -1.318 . . . . 1.06 107.441 178.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.0 122.24 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.159 0 O-C-N 121.164 -0.96 . . . . 1.04 109.456 -178.611 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 38.1 m-85 -103.12 125.17 49.71 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.317 -0.864 . . . . 0.13 109.549 179.711 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.475 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 6.0 mp -110.09 142.04 42.1 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -0.999 . . . . 1.08 109.585 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -109.41 132.33 54.23 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 106.897 -1.52 . . . . 1.13 106.897 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.2 t -130.28 134.17 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 121.231 -0.918 . . . . 1.03 110.856 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 40.8 t0 -96.35 120.85 37.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.564 -0.71 . . . . 1.05 109.44 179.795 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.4 m -67.81 -19.35 24.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.635 -1.29 . . . . 1.04 108.464 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.9 m-20 -92.24 -43.68 9.17 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.483 -0.761 . . . . 1.08 111.446 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 33.4 m-20 -93.25 -21.87 19.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.535 -1.353 . . . . 1.07 108.355 179.914 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -117.61 38.57 3.57 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 107.982 -1.118 . . . . 1.03 107.982 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -59.83 -22.19 61.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.814 -0.554 . . . . 1.92 109.903 -178.757 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.519 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -63.93 -38.86 92.63 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.123 -0.986 . . . . 1.05 108.943 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.519 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 12.0 t -72.48 -43.98 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 O-C-N 121.319 -0.863 . . . . 1.1 109.952 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -40.16 75.63 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.564 -0.71 . . . . 1.03 111.118 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -63.02 -32.69 74.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.909 -1.119 . . . . 0.89 108.884 -179.392 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -39.89 95.64 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.839 -0.8 . . . . 2.06 108.839 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.28 0.52 56.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.601 -0.687 . . . . 1.05 109.872 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 54.52 50.17 16.64 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.273 -0.892 . . . . 2.02 109.718 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.37 131.35 28.88 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 C-N-CA 118.153 -1.419 . . . . 1.05 108.732 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -104.86 -10.48 17.31 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.94 -0.475 . . . . 2.16 110.15 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.93 152.28 15.24 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.834 -1.166 . . . . 1.04 110.915 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -124.99 154.12 71.24 Favored Pre-proline 0 N--CA 1.5 2.07 0 N-CA-C 107.388 -1.338 . . . . 1.04 107.388 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -77.37 144.21 76.97 Favored 'Cis proline' 0 N--CA 1.487 1.107 0 C-N-CA 123.601 -1.416 . . . . 0.19 112.062 -2.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.3 m -129.96 133.87 47.08 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.199 -1.037 . . . . 1.04 108.199 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.425 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 84.1 m-85 -112.46 132.24 55.16 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.356 -0.979 . . . . 0.23 108.356 -179.339 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -123.15 142.79 50.51 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.285 -0.884 . . . . 0.43 108.976 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -108.17 132.12 53.95 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-O 121.712 0.768 . . . . 0.17 111.395 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -125.77 145.44 50.2 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.239 -0.652 . . . . 0.17 109.239 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.4 ' HZ3' ' HG ' ' A' ' 22' ' ' LEU . 11.9 tttp -147.7 131.44 16.96 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.251 -1.389 . . . . 2.18 107.251 178.699 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 59.0 mttp 56.22 26.76 10.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.564 -1.273 . . . . 1.8 107.564 -177.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.07 17.46 79.68 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 110.354 -1.098 . . . . 0.23 110.354 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.7 mm-40 -117.93 136.71 53.31 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.47 -1.018 . . . . 2.75 109.869 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -79.41 122.21 26.13 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.119 -0.988 . . . . 2.3 108.457 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 19.0 m -122.82 11.88 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.595 -0.691 . . . . 1.06 111.304 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.26 155.46 15.99 Favored Glycine 0 N--CA 1.496 2.694 0 C-N-CA 118.589 -1.767 . . . . 0.22 111.254 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.512 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.54 148.18 7.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.809 -0.818 . . . . 1.93 109.478 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.512 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.8 p90 -167.05 159.03 12.77 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.353 -0.842 . . . . 0.16 110.05 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.5 p -127.08 161.41 28.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.647 -0.658 . . . . 0.9 109.486 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.77 141.71 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 108.995 -1.642 . . . . 0.12 108.995 179.525 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.16 67.12 5.87 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.391 -1.064 . . . . 1.04 110.078 -179.502 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.1 t-20 -120.25 99.37 6.55 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.355 -0.98 . . . . 1.36 108.355 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.427 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -67.82 -32.25 72.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 1.6 111.726 -178.822 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -65.97 -28.07 68.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.594 -1.317 . . . . 1.61 109.643 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.46 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 21.6 ttmt -61.0 -35.26 76.37 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 108.779 -0.822 . . . . 2.02 108.779 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 75.1 mt -59.64 -38.83 82.44 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.101 0.953 . . . . 1.05 108.949 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.413 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 9.6 tp10 -63.23 -43.52 97.83 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 120.109 -0.637 . . . . 2.1 111.53 -177.811 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.11 -43.64 77.98 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.988 -1.07 . . . . 1.06 111.613 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.08 -40.13 94.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.739 -1.226 . . . . 1.04 109.739 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.0 mt -60.05 -50.02 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.155 -1.054 . . . . 1.04 108.155 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -59.7 -35.3 74.23 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 122.041 0.924 . . . . 1.09 108.588 178.811 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -67.89 -39.84 83.59 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.532 -0.73 . . . . 2.21 109.971 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.8 mt -99.99 -0.89 38.42 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.214 -0.929 . . . . 1.05 111.273 -179.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.7 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 120.481 -1.387 . . . . 1.08 109.265 -179.599 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo . . . . . 0 N--CA 1.495 1.593 0 CA-C-O 121.106 0.378 . . . . 1.75 112.611 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.27 124.98 40.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.208 -0.933 . . . . 1.35 109.189 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 27.5 m -112.34 130.64 55.89 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.53 -0.732 . . . . 1.36 109.529 -179.463 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.46 -28.65 68.05 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.359 -0.838 . . . . 1.24 109.883 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt -59.05 -26.83 64.95 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.923 -1.111 . . . . 1.89 109.559 -179.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 38.3 mm -128.77 141.05 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 N-CA-C 109.541 -0.54 . . . . 1.03 109.541 179.764 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 34.7 m -98.47 127.27 44.33 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.837 -1.542 . . . . 0.19 106.837 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -77.54 139.36 39.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.688 -1.258 . . . . 0.93 110.738 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.458 ' C ' ' H ' ' B' ' 69' ' ' VAL . 21.1 m95 -74.52 -10.9 60.01 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.122 -0.987 . . . . 0.21 109.253 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -51.64 -12.23 0.17 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.425 -0.797 . . . . 0.49 109.16 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.458 ' H ' ' C ' ' B' ' 67' ' ' TRP . 11.4 m -59.46 136.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.22 -0.925 . . . . 1.66 110.204 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -59.85 -40.12 87.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.258 -0.901 . . . . 1.36 109.343 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.513 -1.435 . . . . 2.32 109.513 -179.745 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.6 mmm . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.062 -0.718 . . . . 3.32 109.062 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.1 148.58 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 121.178 -0.951 . . . . 1.16 109.757 -179.479 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -130.4 130.03 43.82 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.881 -0.785 . . . . 2.18 108.881 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -94.71 126.16 39.84 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.898 -1.519 . . . . 0.4 106.898 178.074 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.9 mm -100.19 115.62 41.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 121.341 -0.85 . . . . 1.04 108.743 -179.786 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -98.55 -1.61 40.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.284 -0.885 . . . . 2.25 110.091 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 7' ' ' SER . . . . . 0.405 ' HG ' ' H ' ' A' ' 10' ' ' ALA . 79.6 p -153.52 157.45 39.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.024 -1.048 . . . . 0.91 111.273 179.982 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.536 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 27.8 ttpt -66.74 -31.72 72.55 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.729 -1.211 . . . . 2.18 107.729 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 23.8 m -56.31 -48.11 77.36 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.703 -0.851 . . . . 1.03 108.703 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . 0.405 ' H ' ' HG ' ' A' ' 7' ' ' SER . . . -71.1 -32.33 68.91 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.935 -0.765 . . . . 1.02 108.935 178.791 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 53.8 t80 -57.02 -42.86 81.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.887 . . . . 0.15 108.802 -179.15 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.01 -42.21 89.98 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 109.024 -0.732 . . . . 2.07 109.024 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.04 -38.56 91.28 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.201 0.525 . . . . 1.77 110.913 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.48 -40.53 89.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.059 -1.026 . . . . 1.04 109.176 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 75.0 mt -60.89 -39.98 91.3 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.412 -0.805 . . . . 1.07 109.412 179.897 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -70.24 -34.66 73.11 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.458 -0.776 . . . . 1.07 110.164 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.2 78.0 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 1.07 110.088 -178.773 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.44 -32.41 71.34 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.279 -0.888 . . . . 1.03 109.299 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.06 -127.25 27.21 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.197 -1.561 . . . . 0.24 109.197 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -90.79 4.08 52.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.109 -1.23 . . . . 1.07 110.693 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.6 mttm -75.13 148.97 39.21 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.846 -1.159 . . . . 2.03 109.633 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.445 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.01 155.85 19.16 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.333 -1.358 . . . . 1.23 107.333 179.591 . . . . . . . . 3 3 . 1 . 021 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.445 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 47.3 t -145.13 121.77 4.15 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 N-CA-C 107.826 -1.175 . . . . 1.03 107.826 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.2 t -110.29 141.07 26.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 108.062 -1.088 . . . . 1.03 108.062 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.8 t -122.51 121.38 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.337 -0.852 . . . . 1.01 109.199 -179.45 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.569 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.7 t70 -99.34 109.31 21.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.46 -0.775 . . . . 1.05 111.114 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -89.88 104.66 17.2 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.688 -1.597 . . . . 0.73 106.688 176.916 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.2 m -129.99 144.21 51.21 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.622 -0.881 . . . . 0.84 108.622 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -82.31 122.39 27.89 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.461 -1.311 . . . . 1.04 107.461 178.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -64.43 -33.13 75.15 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.209 -1.034 . . . . 1.08 108.209 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . . . . . . . . . 53.0 p-90 -71.8 -27.25 62.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.414 -0.803 . . . . 0.29 110.541 179.283 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -82.69 115.82 21.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.981 -1.075 . . . . 0.26 108.549 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.457 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.42 -51.9 54.89 Favored Glycine 0 N--CA 1.484 1.876 0 C-N-CA 120.535 -0.841 . . . . 0.28 111.329 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -52.03 -35.48 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 CA-C-N 118.689 1.245 . . . . 0.5 112.734 -179.153 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.83 -54.83 6.31 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.149 -0.969 . . . . 1.04 110.187 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -61.19 -36.28 79.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.114 -0.991 . . . . 2.12 109.76 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 30.0 ttp -58.1 -27.39 63.65 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.26 -0.9 . . . . 2.66 109.041 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 65.2 mt -87.52 -9.19 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 112.178 0.436 . . . . 1.22 112.178 -179.099 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 30.1 pttt -68.2 -30.45 2.66 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 119.965 -1.709 . . . . 1.44 113.437 -177.545 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.6 Cg_exo -49.83 -37.55 45.63 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 CA-C-N 121.843 1.694 . . . . 0.31 112.826 -178.54 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -68.09 -42.88 79.67 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 117.359 -1.736 . . . . 0.45 106.857 178.35 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -61.13 -53.64 54.54 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.349 -0.844 . . . . 0.16 109.815 178.358 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -67.73 -40.4 84.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.35 110.78 -179.622 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.41 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 71.2 m -60.44 -39.92 89.24 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.117 -0.989 . . . . 0.77 111.442 -179.611 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.91 -20.2 65.67 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.093 -1.004 . . . . 1.07 110.88 -177.986 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.7 m -51.28 -39.86 57.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.851 -1.156 . . . . 0.87 109.211 -178.559 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -81.33 -17.44 49.16 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.246 -0.909 . . . . 2.16 109.588 179.484 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -76.87 -38.4 53.72 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.273 -1.38 . . . . 2.29 107.273 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -121.21 68.72 0.89 Allowed 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 106.298 -1.742 . . . . 0.95 106.298 177.672 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -63.11 -9.02 9.03 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.707 -0.849 . . . . 0.89 108.707 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -91.14 8.53 35.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.684 -0.635 . . . . 1.13 109.433 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 49.4 t -126.86 147.02 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 107.849 -1.167 . . . . 1.06 107.849 179.284 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.2 mm -99.53 120.96 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 120.987 -1.071 . . . . 1.04 109.794 -178.422 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 57.1 m-85 -102.9 123.89 47.38 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.38 -0.825 . . . . 0.13 109.728 179.714 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.438 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.1 mp -111.73 142.06 44.55 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.038 -1.039 . . . . 1.08 110.225 178.633 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.34 133.04 53.64 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 107.498 -1.297 . . . . 1.13 107.498 177.868 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.8 t -128.99 139.05 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.312 -0.868 . . . . 1.03 111.604 -178.149 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -102.28 120.04 39.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.135 -0.691 . . . . 1.05 109.135 179.433 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -68.13 -18.65 23.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.797 -1.189 . . . . 1.04 108.471 178.823 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -92.37 -41.53 10.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.387 -0.821 . . . . 1.08 111.608 -178.736 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -95.93 -15.05 22.62 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.602 -1.311 . . . . 1.07 108.122 179.085 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.64 39.69 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.228 -1.397 . . . . 1.03 107.228 179.031 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -60.98 -20.1 61.95 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.307 0.575 . . . . 1.92 109.48 -178.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.536 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 5.0 p-10 -67.4 -39.95 85.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.261 -0.899 . . . . 1.05 109.653 179.505 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -73.13 -42.55 58.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.659 0.743 . . . . 1.1 109.655 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -39.97 72.62 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.491 -0.756 . . . . 1.03 110.431 -179.39 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.536 ' HG ' ' N ' ' A' ' 68' ' ' GLU . 98.7 p -60.46 -35.77 76.67 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.096 -1.003 . . . . 0.89 108.766 -179.537 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.536 ' N ' ' HG ' ' A' ' 67' ' ' SER . 67.0 tt0 -62.41 -39.88 94.7 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.509 -0.745 . . . . 2.06 109.393 179.547 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.06 -1.73 57.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 1.05 111.164 -178.878 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 54.85 50.02 16.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.078 -1.014 . . . . 2.02 109.391 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.3 t -66.79 131.54 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.881 -1.137 . . . . 1.05 109.188 -178.931 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -103.95 -10.77 17.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.626 -0.672 . . . . 2.16 110.23 -179.534 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.443 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.24 155.32 20.24 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.829 -1.169 . . . . 1.04 110.434 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -130.1 153.86 81.18 Favored Pre-proline 0 N--CA 1.501 2.077 0 N-CA-C 107.818 -1.178 . . . . 1.04 107.818 179.017 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -75.66 142.56 74.39 Favored 'Cis proline' 0 N--CA 1.496 1.624 0 C-N-CA 123.73 -1.363 . . . . 0.19 113.192 -2.273 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.443 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -125.71 132.25 52.42 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.147 -1.057 . . . . 1.04 108.147 177.602 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.569 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 89.0 m-85 -108.2 130.64 55.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.742 -0.836 . . . . 0.23 108.742 -179.261 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -122.38 141.25 51.77 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.135 -1.061 . . . . 0.43 108.135 179.438 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -108.66 132.41 53.94 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.559 0.695 . . . . 0.17 110.643 -178.818 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -125.95 146.01 50.04 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.497 0.665 . . . . 0.17 109.925 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -149.59 131.14 14.85 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 107.975 -1.12 . . . . 2.18 107.975 179.062 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 57.34 27.52 13.9 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.467 -0.938 . . . . 1.8 108.467 -178.905 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.96 21.47 76.22 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.887 -1.285 . . . . 0.23 109.887 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -127.79 142.68 51.24 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -1.091 . . . . 2.75 110.043 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.488 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 76.3 tttt -79.96 129.79 34.77 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.014 -1.054 . . . . 2.3 109.166 179.665 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.4 m -123.01 4.6 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.637 -0.665 . . . . 1.06 110.741 -179.166 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 173.84 161.03 23.25 Favored Glycine 0 N--CA 1.495 2.577 0 C-N-CA 118.218 -1.944 . . . . 0.22 111.844 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.488 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 58.2 tt0 -163.9 151.88 12.88 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.714 -0.874 . . . . 1.93 109.479 179.04 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.538 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 6.7 p90 -166.72 157.15 11.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.435 -0.791 . . . . 0.16 109.781 177.983 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -127.51 163.05 24.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.812 0.815 . . . . 0.9 110.753 -178.606 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.63 143.96 7.15 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.208 -1.557 . . . . 0.12 109.208 179.373 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.85 67.14 2.21 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.364 -1.08 . . . . 1.04 110.403 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.2 91.19 3.48 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 108.455 -0.943 . . . . 1.36 108.455 178.197 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.73 72.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.022 -1.048 . . . . 1.6 111.353 -179.162 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -65.29 -29.84 70.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.753 -1.217 . . . . 1.61 109.961 -179.703 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.538 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 56.1 tttm -60.32 -35.8 76.44 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.374 -0.829 . . . . 2.02 109.296 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.0 mt -58.09 -39.24 78.1 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.738 -0.838 . . . . 1.05 108.738 179.685 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -61.8 -43.67 98.39 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 119.883 -0.727 . . . . 2.1 110.964 -178.407 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.39 -43.23 77.76 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.011 -1.055 . . . . 1.06 111.357 -178.709 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -64.63 -39.55 93.89 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.824 -1.173 . . . . 1.04 110.158 -178.285 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.44 -48.38 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.126 -0.984 . . . . 1.04 108.428 179.168 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.6 t-20 -59.95 -37.05 78.41 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.104 0.954 . . . . 1.09 108.689 179.226 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -67.33 -38.81 85.51 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.79 -0.569 . . . . 2.21 110.088 -178.341 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 79.6 mt -100.07 -2.88 33.16 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.918 -1.114 . . . . 1.05 111.367 -179.269 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.3 p . . . . . 0 N--CA 1.496 1.845 0 O-C-N 120.48 -1.388 . . . . 1.08 109.347 -179.661 . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.496 1.647 0 CA-C-O 121.19 0.412 . . . . 1.75 112.262 . . . . . . . . . 0 0 . 1 . 021 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.76 126.82 39.16 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.051 -1.03 . . . . 1.35 108.875 179.429 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 26.7 m -109.36 128.91 55.48 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.389 -0.82 . . . . 1.36 109.82 -179.428 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.8 -29.81 70.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.487 -0.758 . . . . 1.24 109.662 -179.917 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp -59.27 -21.33 59.46 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 1.89 109.332 -179.515 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 30.7 mm -130.74 141.07 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 N-CA-C 109.497 -0.557 . . . . 1.03 109.497 -179.607 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 64.9 m -95.91 131.66 42.02 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.518 -1.289 . . . . 0.19 107.518 177.828 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -80.18 139.32 36.83 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.811 -1.18 . . . . 0.93 111.384 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.472 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.1 m95 -78.03 -9.46 59.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.061 -1.024 . . . . 0.21 108.813 178.937 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -53.8 -11.35 0.39 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.136 -0.978 . . . . 0.49 108.525 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.472 ' H ' ' C ' ' B' ' 67' ' ' TRP . 31.5 m -61.62 134.16 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.431 -0.793 . . . . 1.66 109.927 -179.977 . . . . . . . . 2 2 . 1 . 021 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.084 -1.01 . . . . 1.36 109.501 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 108.964 -1.654 . . . . 2.32 108.964 -179.389 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.1 mmm . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 121.168 0.508 . . . . 3.32 109.682 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.457 ' CG1' ' N ' ' A' ' 3' ' ' LYS . 69.5 t -99.17 163.6 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.557 -0.714 . . . . 1.16 110.089 -179.559 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.457 ' N ' ' CG1' ' A' ' 2' ' ' VAL . 27.1 tptp -129.98 125.09 34.54 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 108.185 -1.042 . . . . 2.18 108.185 179.396 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -95.06 123.75 38.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.008 -1.058 . . . . 0.4 109.027 179.788 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.87 111.97 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.513 -0.921 . . . . 1.04 108.513 179.509 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -96.64 -0.2 48.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.168 -0.957 . . . . 2.25 110.212 -179.355 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.43 156.89 36.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.787 -1.196 . . . . 0.91 110.803 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.457 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 33.5 ttmt -64.04 -32.76 74.42 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.8 -1.185 . . . . 2.18 107.8 177.866 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.9 m -56.13 -48.34 76.43 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.425 -0.91 . . . . 1.03 108.963 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.55 -31.36 70.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.247 -0.908 . . . . 1.02 109.28 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 54.2 t80 -58.99 -44.66 91.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.15 109.549 -178.906 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -64.11 -40.99 97.4 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.202 -1.036 . . . . 2.07 108.202 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -65.15 -36.7 85.06 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.562 0.696 . . . . 1.77 110.344 179.401 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.79 -43.84 78.76 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.795 -0.817 . . . . 1.04 108.795 -179.092 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 89.6 mt -60.67 -39.5 88.65 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.376 -0.972 . . . . 1.07 108.376 178.914 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.01 -32.96 72.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.428 -0.795 . . . . 1.07 109.962 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.2 63.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.13 -0.981 . . . . 1.07 110.539 -179.211 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.52 -30.08 70.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.05 -1.031 . . . . 1.03 109.555 -179.682 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.9 -127.37 24.96 Favored Glycine 0 N--CA 1.487 2.089 0 N-CA-C 110.08 -1.208 . . . . 0.24 110.08 -179.895 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -92.78 4.24 54.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.362 -1.081 . . . . 1.07 110.44 -179.139 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -75.45 151.33 38.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.172 -0.955 . . . . 2.03 109.388 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.467 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -61.3 156.03 19.78 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 107.54 -1.282 . . . . 1.23 107.54 -179.732 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.467 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 60.7 t -142.69 119.57 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.064 -1.023 . . . . 1.03 108.469 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -105.89 139.82 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 N-CA-C 107.72 -1.215 . . . . 1.03 107.72 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 32.9 t -123.58 120.3 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.151 -0.968 . . . . 1.01 109.295 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.557 ' CG ' ' HG ' ' A' ' 28' ' ' SER . 62.7 t0 -98.53 118.51 35.39 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.375 -0.828 . . . . 1.05 110.079 179.632 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -94.63 24.83 4.34 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.09 -1.007 . . . . 0.73 109.803 179.16 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.557 ' HG ' ' CG ' ' A' ' 26' ' ' ASP . 52.8 m -60.16 147.69 38.86 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.01 -1.056 . . . . 0.84 110.618 -179.011 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.83 124.0 31.09 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.602 -1.259 . . . . 1.04 107.602 178.81 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.4 t -66.96 -29.2 68.99 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 108.098 -1.075 . . . . 1.08 108.098 179.694 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.535 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 63.9 p-90 -75.53 -19.09 59.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.521 -0.737 . . . . 0.29 110.435 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.0 t -87.29 111.7 21.31 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.668 -1.234 . . . . 0.26 107.668 179.971 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.71 -50.93 62.42 Favored Glycine 0 N--CA 1.486 1.992 0 C-N-CA 120.557 -0.83 . . . . 0.28 111.379 -178.13 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.78 -35.94 50.07 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 CA-C-N 118.964 1.382 . . . . 0.5 111.234 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.54 -45.11 22.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.378 -0.826 . . . . 1.04 109.826 179.222 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -59.95 -31.34 69.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.162 -0.961 . . . . 2.12 108.841 179.621 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.521 ' O ' ' SD ' ' A' ' 37' ' ' MET . 12.2 tmm? -60.37 -29.59 69.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.582 -0.699 . . . . 2.66 109.642 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.5 mt -81.12 -5.56 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.741 -0.6 . . . . 1.22 111.106 -179.434 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.42 -30.86 7.78 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 119.881 -1.762 . . . . 1.44 112.971 -176.787 . . . . . . . . 3 3 . 1 . 022 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.0 Cg_exo -59.72 -38.46 80.87 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 CA-C-N 121.722 1.651 . . . . 0.31 112.29 -178.529 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -71.43 -50.82 28.01 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.412 -1.315 . . . . 0.45 108.759 179.449 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.7 -48.64 80.88 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.217 -0.927 . . . . 0.16 109.252 179.129 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -67.5 -44.74 77.75 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.681 -0.637 . . . . 0.35 110.969 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.462 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 63.4 m -62.13 -36.42 81.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.953 -1.092 . . . . 0.77 110.35 -179.886 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 mt -60.13 -26.12 66.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.198 -0.939 . . . . 1.07 110.477 -178.631 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.5 m -53.45 -41.79 66.5 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.79 -1.194 . . . . 0.87 108.428 -179.495 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.415 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 39.9 mp0 -86.06 -16.86 36.79 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.299 -0.876 . . . . 2.16 110.049 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -78.03 -37.22 47.39 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 106.516 -1.661 . . . . 2.29 106.516 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -123.12 70.03 1.02 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.266 -1.383 . . . . 0.95 107.266 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.6 p -65.67 -7.83 17.42 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.835 -0.802 . . . . 0.89 108.835 -179.498 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -88.47 3.9 48.47 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.685 -0.857 . . . . 1.13 108.685 179.023 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 39.7 t -126.4 145.56 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.562 -1.273 . . . . 1.06 107.562 178.909 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mm -98.67 121.86 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.045 . . . . 1.04 109.574 -178.32 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 39.9 m-85 -102.63 123.86 47.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.24 -0.912 . . . . 0.13 109.747 179.525 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.47 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.9 mp -110.39 140.16 44.89 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.266 -0.896 . . . . 1.08 109.696 178.957 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -109.98 130.0 55.59 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 106.831 -1.544 . . . . 1.13 106.831 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.9 136.72 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 CA-C-O 121.51 0.671 . . . . 1.03 110.474 -178.232 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.8 t0 -98.92 121.69 41.2 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 1.05 109.729 -179.836 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -68.31 -17.49 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 120.98 -1.075 . . . . 1.04 108.702 179.02 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.7 m-20 -94.48 -41.99 9.08 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.525 -0.735 . . . . 1.08 111.591 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -96.91 -13.86 22.16 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.644 -1.285 . . . . 1.07 108.476 179.506 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.63 37.88 4.31 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.052 -1.462 . . . . 1.03 107.052 179.6 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.28 -21.85 62.43 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.972 -0.751 . . . . 1.92 108.972 -178.961 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.457 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 2.6 p30 -64.86 -39.64 93.87 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.134 -0.979 . . . . 1.05 108.964 179.215 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.5 t -73.59 -44.13 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.394 -0.816 . . . . 1.1 109.781 -179.65 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.27 72.03 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.381 -0.824 . . . . 1.03 110.71 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.8 p -61.2 -32.86 72.62 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.998 -1.064 . . . . 0.89 109.091 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -64.65 -39.92 94.54 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.488 -0.757 . . . . 2.06 110.19 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.81 1.66 53.34 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.292 -0.88 . . . . 1.05 110.677 -178.647 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 55.79 49.64 15.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.02 109.58 -179.538 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.77 130.65 30.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 C-N-CA 118.468 -1.293 . . . . 1.05 108.373 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -104.53 -10.8 17.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.628 -0.67 . . . . 2.16 109.968 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.78 155.85 22.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.9 -1.125 . . . . 1.04 110.991 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.68 156.26 79.08 Favored Pre-proline 0 N--CA 1.498 1.974 0 N-CA-C 107.819 -1.178 . . . . 1.04 107.819 179.087 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -76.06 139.67 61.78 Favored 'Cis proline' 0 N--CA 1.497 1.681 0 C-N-CA 123.969 -1.263 . . . . 0.19 112.611 -2.489 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -124.43 135.63 53.41 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 108.772 -0.825 . . . . 1.04 108.772 178.391 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -113.12 131.75 55.71 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 109.121 -0.696 . . . . 0.23 109.121 -179.572 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -122.09 140.09 52.93 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.139 -1.06 . . . . 0.43 108.139 178.985 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -107.65 133.41 52.12 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.775 -0.578 . . . . 0.17 110.198 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -126.23 148.65 49.43 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.013 -0.736 . . . . 0.17 109.013 179.136 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -148.58 126.82 12.17 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 107.644 -1.243 . . . . 2.18 107.644 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.1 mttp 57.63 25.23 11.42 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.704 -1.221 . . . . 1.8 107.704 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.5 16.88 77.03 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 110.096 -1.202 . . . . 0.23 110.096 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 4.7 mm-40 -116.23 135.67 53.7 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.482 -1.011 . . . . 2.75 109.964 -179.628 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.503 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 80.9 tttt -81.54 122.5 27.65 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.307 -0.997 . . . . 2.3 108.307 178.32 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.3 m -123.29 9.87 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.648 -0.658 . . . . 1.06 110.811 -179.266 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.56 151.67 9.72 Favored Glycine 0 N--CA 1.499 2.885 0 C-N-CA 118.184 -1.96 . . . . 0.22 112.201 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.503 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 67.9 tt0 -164.48 151.22 11.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.684 -0.892 . . . . 1.93 109.341 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 21.5 p90 -163.21 161.27 24.82 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.768 -0.827 . . . . 0.16 108.768 177.423 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -125.92 160.05 30.97 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.554 0.692 . . . . 0.9 110.059 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.76 141.97 5.8 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.851 -1.699 . . . . 0.12 108.851 179.673 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.73 65.28 4.85 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.101 -1.235 . . . . 1.04 109.818 -179.553 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.9 t-20 -119.46 100.21 7.15 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.142 -1.058 . . . . 1.36 108.142 178.538 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.09 -32.36 72.63 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.346 -0.846 . . . . 1.6 111.538 -179.026 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.48 -29.55 70.22 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.968 -1.082 . . . . 1.61 109.812 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.502 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 78.2 tttt -60.18 -38.28 82.75 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.982 -0.748 . . . . 2.02 108.982 -179.153 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 44.1 mt -57.14 -39.43 75.17 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.993 0.902 . . . . 1.05 108.743 179.431 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -61.66 -41.99 98.29 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 120.074 -0.65 . . . . 2.1 110.632 -177.989 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.41 -44.09 75.78 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.261 -0.899 . . . . 1.06 111.227 -179.095 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.2 m -66.16 -40.01 90.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.899 -1.126 . . . . 1.04 109.903 -178.445 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -60.92 -49.73 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 107.987 -1.116 . . . . 1.04 107.987 178.883 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.5 t-20 -59.95 -35.35 74.76 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.853 0.835 . . . . 1.09 108.752 178.877 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -67.19 -39.99 86.46 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.715 -0.616 . . . . 2.21 110.019 -178.74 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.0 mt -100.25 -1.87 35.26 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.316 -0.865 . . . . 1.05 111.206 -178.979 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.4 p . . . . . 0 N--CA 1.498 1.974 0 O-C-N 120.554 -1.341 . . . . 1.08 109.269 -179.64 . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo . . . . . 0 N--CA 1.491 1.381 0 CA-C-O 121.372 0.488 . . . . 1.75 111.716 . . . . . . . . . 0 0 . 1 . 022 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.3 121.29 36.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.345 -0.847 . . . . 1.35 108.819 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 28.9 m -102.37 128.52 48.91 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.226 -0.921 . . . . 1.36 109.545 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 66.3 mt -69.37 -30.2 68.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.316 -0.865 . . . . 1.24 109.355 179.455 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt -62.31 -19.46 63.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.591 -0.693 . . . . 1.89 109.539 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 30.3 mm -131.72 141.86 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 121.672 -0.642 . . . . 1.03 109.527 -179.765 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -101.73 126.5 48.6 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 107.688 -1.227 . . . . 0.19 107.688 177.649 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -76.97 144.35 38.82 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.988 -1.07 . . . . 0.93 110.813 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.478 ' C ' ' H ' ' B' ' 69' ' ' VAL . 25.5 m95 -79.47 -17.04 55.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.334 -0.854 . . . . 0.21 109.44 179.409 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.56 -11.13 1.17 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.868 -1.16 . . . . 0.49 107.868 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.478 ' H ' ' C ' ' B' ' 67' ' ' TRP . 7.7 p -64.96 143.98 15.25 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 N-CA-C 109.153 -0.684 . . . . 1.66 109.153 179.739 . . . . . . . . 2 2 . 1 . 022 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -60.15 -39.16 85.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 1.36 109.64 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.27 0 CA-C-O 117.975 -1.458 . . . . 2.32 109.583 -179.857 . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.0 mmm . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 108.755 -0.832 . . . . 3.32 108.755 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.448 ' CG1' ' N ' ' A' ' 3' ' ' LYS . 79.3 t -98.7 163.91 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.198 -0.938 . . . . 1.16 109.327 -179.906 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.448 ' N ' ' CG1' ' A' ' 2' ' ' VAL . 18.4 tptp -129.45 128.69 43.43 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 107.787 -1.19 . . . . 2.18 107.787 179.848 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -96.13 121.97 38.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.16 -0.963 . . . . 0.4 108.882 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.412 HG22 HD11 ' A' ' 5' ' ' ILE . 25.2 mm -102.21 117.5 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 107.793 -1.188 . . . . 1.04 107.793 179.379 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.7 mp0 -99.38 -0.75 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.921 -1.112 . . . . 2.25 109.993 -178.879 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.83 158.11 38.91 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.973 -1.079 . . . . 0.91 110.942 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -63.1 -32.79 74.25 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.467 -0.938 . . . . 2.18 108.467 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.0 m -57.65 -47.89 81.0 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.114 -0.991 . . . . 1.03 108.811 -179.484 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.18 -31.15 70.49 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.253 -0.905 . . . . 1.02 108.694 178.551 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 52.0 t80 -59.4 -43.86 92.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.15 108.655 179.956 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -66.05 -41.81 90.33 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.912 -0.773 . . . . 2.07 108.912 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -65.52 -35.68 81.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 1.77 110.307 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.04 -41.35 77.78 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.13 -0.982 . . . . 1.04 109.268 -179.406 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.7 mt -61.09 -39.9 91.67 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.192 -0.943 . . . . 1.07 108.549 179.705 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.17 -35.39 76.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.651 -0.655 . . . . 1.07 109.999 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.54 -35.85 75.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.293 -0.88 . . . . 1.07 110.486 -179.142 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.63 75.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.082 -1.011 . . . . 1.03 109.867 -179.72 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.07 -126.11 22.75 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.882 -1.287 . . . . 0.24 109.882 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -90.96 3.48 54.53 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.035 -1.273 . . . . 1.07 110.269 -178.886 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mttt -75.4 150.43 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.858 -1.151 . . . . 2.03 109.111 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.481 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.76 159.07 11.58 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 107.244 -1.391 . . . . 1.23 107.244 179.573 . . . . . . . . 3 3 . 1 . 023 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.481 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 94.2 t -145.66 120.06 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.87 -1.144 . . . . 1.03 108.712 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.9 t -108.35 142.6 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 107.955 -1.128 . . . . 1.03 107.955 179.551 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.7 118.76 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.189 -0.944 . . . . 1.01 109.157 -179.273 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.555 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 31.8 t70 -97.33 120.31 37.45 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.36 -0.837 . . . . 1.05 109.852 179.082 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -96.7 24.06 6.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.237 -0.914 . . . . 0.73 110.024 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.8 m -57.48 141.94 45.87 Favored 'General case' 0 C--N 1.294 -1.812 0 O-C-N 121.233 -0.917 . . . . 0.84 110.55 -178.243 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -81.65 125.52 30.67 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.671 -1.233 . . . . 1.04 107.671 179.138 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.72 -33.34 74.7 Favored 'General case' 0 C--N 1.295 -1.796 0 C-N-CA 118.94 -1.104 . . . . 1.08 108.342 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.542 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 67.6 p-90 -70.48 -24.23 62.82 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.669 . . . . 0.29 110.902 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.93 123.11 29.62 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.565 -1.272 . . . . 0.26 107.565 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.462 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.58 -51.82 39.18 Favored Glycine 0 N--CA 1.489 2.179 0 C-N-CA 120.27 -0.967 . . . . 0.28 111.235 -178.087 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -53.44 -33.87 69.12 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 CA-C-N 118.524 1.162 . . . . 0.5 111.443 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.52 -53.98 7.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.471 -0.768 . . . . 1.04 110.166 -179.896 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -60.08 -36.94 78.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.061 -1.024 . . . . 2.12 109.76 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.498 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -60.15 -30.95 69.64 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.232 -0.917 . . . . 2.66 109.917 -179.11 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.419 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 70.0 mt -81.38 -4.5 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.863 -0.523 . . . . 1.22 111.324 -179.335 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.1 ptmt -64.85 -28.79 3.05 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 120.558 -1.339 . . . . 1.44 113.567 -177.179 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.8 Cg_exo -55.62 -39.64 89.93 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 CA-C-N 121.952 1.733 . . . . 0.31 113.22 -176.316 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -68.14 -44.61 75.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.815 -1.554 . . . . 0.45 108.319 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.33 -54.82 41.06 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.409 -0.807 . . . . 0.16 110.405 178.815 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -67.65 -41.14 84.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.494 -0.754 . . . . 0.35 110.939 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.441 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 64.1 m -62.14 -36.48 81.93 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.0 -1.063 . . . . 0.77 110.91 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -63.87 -19.37 65.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.214 -0.929 . . . . 1.07 110.04 -178.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -53.05 -39.53 63.32 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.91 -1.144 . . . . 0.87 107.91 -179.533 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 35.5 mp0 -82.96 -16.41 47.43 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.375 -0.828 . . . . 2.16 109.397 179.154 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -76.91 -39.0 52.39 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.513 -1.292 . . . . 2.29 107.513 179.166 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -123.7 67.81 1.03 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.3 -1.37 . . . . 0.95 107.3 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.2 p -62.89 -9.08 8.42 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.876 -0.787 . . . . 0.89 108.876 -179.467 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -90.13 6.91 40.52 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.288 -1.004 . . . . 1.13 108.288 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 55.2 t -125.05 145.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.041 -1.096 . . . . 1.06 108.041 179.42 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.5 mm -99.96 122.83 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 120.956 -1.09 . . . . 1.04 109.476 -178.549 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -102.95 126.95 50.33 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.13 109.992 179.731 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.474 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.2 mp -111.32 139.98 46.27 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.128 -0.983 . . . . 1.08 109.717 178.861 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -110.2 130.11 55.6 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 107.086 -1.45 . . . . 1.13 107.086 178.124 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.2 t -127.76 136.25 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.401 -0.812 . . . . 1.03 110.533 -177.847 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.6 t0 -98.69 120.34 38.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.363 -0.836 . . . . 1.05 108.95 179.507 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -66.74 -18.25 23.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 120.479 -1.388 . . . . 1.04 108.209 179.36 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 18.8 m-20 -93.8 -44.0 8.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.279 -0.888 . . . . 1.08 111.545 -179.097 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.8 m-20 -93.95 -13.49 27.01 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.537 -1.352 . . . . 1.07 108.423 179.586 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.24 38.38 4.19 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.578 -1.267 . . . . 1.03 107.578 179.518 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -59.9 -23.85 63.82 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.854 -0.528 . . . . 1.92 109.882 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.532 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -66.49 -38.26 86.87 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.034 -1.041 . . . . 1.05 108.984 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.532 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 16.2 t -69.95 -43.96 78.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.308 -0.87 . . . . 1.1 109.573 179.868 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 -36.33 64.0 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.449 -0.782 . . . . 1.03 111.235 -178.595 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 67' ' ' SER . . . . . 0.532 ' HG ' ' N ' ' A' ' 68' ' ' GLU . 89.2 p -60.12 -37.73 80.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.773 -1.204 . . . . 0.89 109.428 -179.41 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.532 ' N ' ' HG ' ' A' ' 67' ' ' SER . 15.2 tm-20 -63.25 -38.13 89.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 2.06 109.526 179.327 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.44 -3.63 58.91 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.448 -0.782 . . . . 1.05 110.313 -178.907 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mp0 54.74 49.61 17.6 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.373 -0.829 . . . . 2.02 109.232 -179.584 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.77 132.21 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 120.846 -1.159 . . . . 1.05 108.576 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -103.48 -11.92 17.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.582 -0.699 . . . . 2.16 110.813 -178.902 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.517 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.97 156.26 24.53 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.751 -1.218 . . . . 1.04 110.596 -179.442 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -128.5 153.36 79.31 Favored Pre-proline 0 N--CA 1.497 1.888 0 N-CA-C 107.455 -1.313 . . . . 1.04 107.455 178.139 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -76.85 140.47 65.27 Favored 'Cis proline' 0 N--CA 1.488 1.205 0 C-N-CA 123.617 -1.409 . . . . 0.19 112.405 -2.655 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.517 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.0 m -124.91 132.64 53.27 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.934 -1.136 . . . . 1.04 107.934 177.475 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.555 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.0 m-85 -111.13 132.02 54.63 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.444 -0.947 . . . . 0.23 108.444 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 83.4 mt-30 -122.23 143.12 49.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.275 -0.89 . . . . 0.43 108.612 179.463 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -109.12 132.68 53.89 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.525 0.679 . . . . 0.17 110.581 -178.589 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -127.53 147.29 50.32 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.473 0.654 . . . . 0.17 109.341 179.194 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -148.9 126.35 11.6 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.74 -1.207 . . . . 2.18 107.74 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.3 mttp 59.86 28.42 17.91 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.518 -0.739 . . . . 1.8 109.072 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.89 19.95 71.72 Favored Glycine 0 N--CA 1.489 2.198 0 O-C-N 121.101 -0.999 . . . . 0.23 111.095 179.281 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -130.46 145.13 51.78 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.045 -1.268 . . . . 2.75 109.94 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -79.87 126.86 31.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.287 -0.883 . . . . 2.3 109.636 179.663 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.6 m -121.63 6.04 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.737 -0.602 . . . . 1.06 110.126 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.81 157.03 21.09 Favored Glycine 0 N--CA 1.494 2.51 0 C-N-CA 118.716 -1.707 . . . . 0.22 111.454 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.453 ' OE2' ' CG2' ' A' ' 76' ' ' THR . 2.3 tp10 -164.95 147.46 8.22 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.518 -0.919 . . . . 1.93 108.518 179.367 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.46 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 4.3 p90 -169.4 155.87 6.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.665 -0.814 . . . . 0.16 109.213 177.932 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.4 p -126.17 162.77 24.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.688 -0.633 . . . . 0.9 110.024 -179.015 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 121.65 140.29 5.83 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.06 -1.616 . . . . 0.12 109.06 179.673 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.26 64.09 2.0 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.286 -1.126 . . . . 1.04 110.537 -179.296 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.3 t-20 -118.85 100.0 7.11 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.376 -0.972 . . . . 1.36 108.376 178.018 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.76 -30.12 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.328 -0.857 . . . . 1.6 111.641 -179.107 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -66.64 -29.85 69.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.875 -1.14 . . . . 1.61 109.76 -179.842 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 52.4 tttp -61.82 -33.92 75.01 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 109.043 -0.725 . . . . 2.02 109.043 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.48 -39.98 85.48 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.707 -0.849 . . . . 1.05 108.707 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.9 -43.96 97.38 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.232 -0.987 . . . . 2.1 110.854 -178.363 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.78 77.84 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.187 -0.946 . . . . 1.06 111.076 -178.362 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 19.6 m -64.74 -39.95 94.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.736 -1.228 . . . . 1.04 108.189 -179.104 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.429 ' O ' ' N ' ' A' ' 105' ' ' VAL . 74.1 mt -65.29 -47.13 88.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 107.671 -1.233 . . . . 1.04 107.671 178.397 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.52 -35.47 76.06 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.657 -1.238 . . . . 1.09 107.657 179.562 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -69.98 -39.23 76.05 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 116.022 -0.535 . . . . 2.21 110.143 -179.33 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.6 mt -98.34 -4.45 34.92 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.061 -1.025 . . . . 1.05 111.398 -178.986 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.429 ' N ' ' O ' ' A' ' 101' ' ' ILE . 9.3 p . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.485 -1.385 . . . . 1.08 109.143 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo . . . . . 0 N--CA 1.492 1.399 0 CA-C-O 120.934 0.306 . . . . 1.75 112.334 . . . . . . . . . 0 0 . 1 . 023 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -105.58 122.58 46.32 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.214 -0.929 . . . . 1.35 109.397 179.327 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.414 HG23 ' H ' ' B' ' 63' ' ' LYS . 56.9 m -107.1 131.21 54.37 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.255 -0.903 . . . . 1.36 109.978 -179.4 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.2 mt -68.09 -30.21 69.33 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.269 -0.894 . . . . 1.24 109.929 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.414 ' H ' HG23 ' B' ' 61' ' ' THR . 42.2 mmtm -65.3 -16.97 64.13 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.134 -0.979 . . . . 1.89 109.578 -179.404 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 33.2 mm -130.42 142.49 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 121.855 -0.528 . . . . 1.03 109.721 -179.46 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 22.2 m -98.49 131.97 44.31 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 107.407 -1.331 . . . . 0.19 107.407 177.57 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.4 m -81.02 139.38 35.79 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.851 -1.155 . . . . 0.93 111.244 -178.2 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.483 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.9 m95 -77.19 -18.28 57.87 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.292 -0.88 . . . . 0.21 109.409 178.882 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . 0.455 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.8 m120 -54.11 -12.57 0.63 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.123 -1.066 . . . . 0.49 108.123 179.354 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.483 ' H ' ' C ' ' B' ' 67' ' ' TRP . 7.4 p -61.89 136.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 109.13 -0.693 . . . . 1.66 109.13 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.96 -28.23 69.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.01 -1.056 . . . . 1.36 109.909 -178.99 . . . . . . . . 1 1 . 1 . 023 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 109.292 -1.523 . . . . 2.32 109.292 -179.732 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 ttm . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.141 -0.688 . . . . 3.32 109.141 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.3 t -98.88 152.8 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.231 -0.918 . . . . 1.16 109.553 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -129.94 123.97 31.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.432 -0.792 . . . . 2.18 109.205 179.924 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -93.37 125.16 37.82 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.742 -0.836 . . . . 0.4 108.742 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mm -99.86 113.59 35.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 N-CA-C 108.422 -0.955 . . . . 1.04 108.422 179.402 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -99.13 -1.04 40.42 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.116 -0.99 . . . . 2.25 109.915 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.3 p -155.38 154.51 32.09 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.108 -0.995 . . . . 0.91 110.999 -179.855 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 ttpp -61.49 -33.96 74.68 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.926 -1.138 . . . . 2.18 107.926 178.711 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 42.1 m -57.55 -44.12 84.95 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.32 -0.952 . . . . 1.03 108.555 -179.446 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.31 69.54 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.25 -0.906 . . . . 1.02 109.037 178.476 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -59.73 -43.2 94.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.257 -0.902 . . . . 0.15 109.028 -179.189 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -66.18 -40.52 90.53 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.688 -0.856 . . . . 2.07 108.688 179.467 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -64.64 -40.93 96.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.292 0.567 . . . . 1.77 110.562 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.9 -40.9 83.37 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.309 -0.869 . . . . 1.04 108.907 -178.972 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 58.0 mt -60.89 -40.03 91.5 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.343 -0.984 . . . . 1.07 108.343 179.197 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -69.99 -34.37 73.25 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.416 -0.803 . . . . 1.07 109.834 179.775 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.99 76.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.225 -0.922 . . . . 1.07 109.926 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.97 74.9 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 1.03 109.025 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.61 18.62 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.879 -1.288 . . . . 0.24 109.879 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -90.19 3.3 53.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.133 -1.216 . . . . 1.07 110.747 -179.053 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mtpt -77.06 149.99 35.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 2.03 109.51 -179.686 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.457 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.9 155.49 19.64 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.082 -1.081 . . . . 1.23 108.082 -179.39 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.457 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 87.6 t -144.35 112.42 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.012 -1.055 . . . . 1.03 109.131 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -99.6 141.9 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.168 -1.049 . . . . 1.03 108.168 179.583 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.98 122.34 63.11 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.217 -0.927 . . . . 1.01 110.196 -178.542 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -99.24 122.94 43.09 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.646 -0.658 . . . . 1.05 109.775 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -99.26 18.54 17.33 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.264 -0.898 . . . . 0.73 109.925 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.5 m -52.05 147.87 6.82 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-O 122.063 0.935 . . . . 0.84 110.618 -178.791 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.76 123.9 31.66 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.444 -1.317 . . . . 1.04 107.444 178.743 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.77 -28.96 68.81 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.195 -1.002 . . . . 1.08 108.332 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.546 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 68.4 p-90 -78.02 -15.82 58.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.496 -0.753 . . . . 0.29 110.977 -179.515 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.7 t -88.22 116.55 26.5 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.877 -1.139 . . . . 0.26 108.04 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.409 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.37 -53.56 44.53 Favored Glycine 0 N--CA 1.489 2.193 0 C-N-CA 120.081 -1.057 . . . . 0.28 111.256 -178.521 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.409 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.99 -35.99 52.16 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.949 1.375 . . . . 0.5 111.612 179.895 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.92 -48.81 17.14 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.438 -0.789 . . . . 1.04 109.662 -179.908 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.04 -37.81 80.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 2.12 109.47 179.514 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 33.0 tpp -59.12 -27.48 65.64 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.517 -0.74 . . . . 2.66 109.27 -179.393 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.435 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 96.6 mt -80.94 -4.08 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.971 -0.456 . . . . 1.22 111.368 -179.772 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.08 5.83 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 120.283 -1.51 . . . . 1.44 113.916 -178.028 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.536 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 30.5 Cg_exo -58.89 -41.42 62.47 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 121.675 1.634 . . . . 0.31 112.379 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . 0.634 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 35.4 m-85 -69.13 -50.21 50.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.693 -1.255 . . . . 0.45 109.547 179.513 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -59.96 -50.82 72.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.027 -1.045 . . . . 0.16 109.447 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -67.54 -40.01 85.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.891 -0.506 . . . . 0.35 110.69 -179.423 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.49 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -63.29 -39.22 93.97 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.957 -1.089 . . . . 0.77 111.085 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.01 -23.43 63.67 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.194 -0.941 . . . . 1.07 110.203 -178.212 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.2 m -52.0 -40.15 60.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 118.72 -1.192 . . . . 0.87 108.765 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -82.82 -16.68 46.77 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.454 -0.779 . . . . 2.16 109.366 179.303 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -75.68 -37.44 59.55 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 107.362 -1.347 . . . . 2.29 107.362 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -124.75 68.71 1.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.077 -1.453 . . . . 0.95 107.077 177.894 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.4 p -62.28 -9.73 8.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.727 -0.842 . . . . 0.89 108.727 -179.255 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -91.92 9.84 31.29 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.644 -0.872 . . . . 1.13 108.644 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 54.8 t -127.58 144.82 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 107.639 -1.245 . . . . 1.06 107.639 178.981 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.2 mm -99.99 122.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.269 -0.895 . . . . 1.04 109.599 -178.55 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 48.0 m-85 -103.06 126.81 50.41 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 108.692 -0.855 . . . . 0.13 108.692 179.25 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.442 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 4.0 mp -110.0 142.11 41.86 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.19 -0.944 . . . . 1.08 109.134 179.803 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -110.68 130.68 55.51 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 106.778 -1.564 . . . . 1.13 106.778 178.073 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.73 131.9 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.436 -0.79 . . . . 1.03 110.113 -178.333 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.403 ' O ' ' N ' ' A' ' 62' ' ' ALA . 45.6 t0 -96.1 119.89 35.4 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.518 -0.739 . . . . 1.05 109.599 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -67.98 -14.91 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.42 -1.425 . . . . 1.04 108.658 179.438 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.546 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 14.1 m-20 -94.45 -44.07 8.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.425 -0.797 . . . . 1.08 111.353 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -96.75 -18.63 19.49 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 120.776 -1.202 . . . . 1.07 108.836 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.403 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -119.03 36.59 4.4 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.346 -1.353 . . . . 1.03 107.346 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.579 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.4 OUTLIER -60.16 -23.55 64.03 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.961 -0.563 . . . . 1.92 110.277 -178.905 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -67.09 -35.43 79.77 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.001 -1.062 . . . . 1.05 108.633 179.5 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 5.6 t -73.36 -43.95 55.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.501 -0.749 . . . . 1.1 109.158 179.376 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.27 -40.77 74.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.393 -0.817 . . . . 1.03 110.957 -178.819 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.7 p -61.81 -32.71 73.04 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.71 -1.244 . . . . 0.89 109.287 -179.636 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -62.95 -38.16 89.97 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.282 -0.886 . . . . 2.06 109.075 179.344 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.54 2.04 55.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.558 -0.714 . . . . 1.05 111.081 -178.806 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 54.39 49.89 17.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.888 -1.133 . . . . 2.02 109.935 179.866 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.2 t -64.8 132.57 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 120.801 -1.187 . . . . 1.05 109.224 -179.114 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.95 -14.03 16.12 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.812 . . . . 2.16 110.056 -179.351 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.0 157.49 21.0 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.881 -1.137 . . . . 1.04 111.031 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -128.79 155.46 79.29 Favored Pre-proline 0 N--CA 1.499 1.99 0 N-CA-C 107.326 -1.361 . . . . 1.04 107.326 178.543 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -76.26 139.98 63.26 Favored 'Cis proline' 0 N--CA 1.49 1.288 0 C-N-CA 123.667 -1.389 . . . . 0.19 112.263 -2.178 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 99.1 m -124.56 139.53 53.79 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.491 -0.929 . . . . 1.04 108.491 178.038 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.471 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 95.4 m-85 -115.66 130.2 56.77 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.724 -0.843 . . . . 0.23 108.724 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -123.45 141.86 51.58 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.577 -0.897 . . . . 0.43 108.577 179.342 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 59.2 m-85 -108.37 137.25 46.65 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.528 0.68 . . . . 0.17 110.333 -179.229 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -129.91 147.31 51.66 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.377 0.608 . . . . 0.17 109.44 179.229 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -148.05 124.31 10.87 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.253 -1.388 . . . . 2.18 107.253 179.371 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 59.83 29.42 18.98 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.136 -1.061 . . . . 1.8 108.136 -178.235 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.59 15.23 81.72 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.611 -1.396 . . . . 0.23 109.611 -179.39 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.4 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.8 mm-40 -115.58 133.83 55.65 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.432 -1.04 . . . . 2.75 110.515 -179.222 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -78.68 124.38 28.13 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.27 -1.011 . . . . 2.3 108.27 178.217 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.7 m -123.93 9.14 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.558 -0.714 . . . . 1.06 110.968 -179.464 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.86 152.58 10.94 Favored Glycine 0 N--CA 1.498 2.816 0 C-N-CA 118.616 -1.754 . . . . 0.22 111.454 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -165.37 147.77 7.79 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.697 -0.884 . . . . 1.93 109.765 179.377 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -163.94 162.03 23.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 119.305 -0.958 . . . . 0.16 109.333 177.072 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -125.4 160.36 29.61 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.515 0.674 . . . . 0.9 109.551 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.03 141.02 5.95 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.907 -1.677 . . . . 0.12 108.907 179.747 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.15 66.31 2.28 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.256 -1.144 . . . . 1.04 109.168 179.99 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.81 92.17 3.72 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.413 -0.804 . . . . 1.36 109.073 179.691 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.634 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.5 OUTLIER -68.08 -32.17 72.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.081 -1.012 . . . . 1.6 111.422 -179.791 . . . . . . . . 3 3 . 1 . 024 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -62.68 -30.13 71.17 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.81 -1.181 . . . . 1.61 109.075 -179.165 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -61.05 -35.66 77.53 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 109.115 -0.698 . . . . 2.02 109.115 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.68 -39.35 84.24 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-O 122.013 0.911 . . . . 1.05 108.892 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.09 -42.89 99.34 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.846 -0.742 . . . . 2.1 110.502 -177.769 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.97 -44.02 73.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 1.06 111.399 -178.998 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.9 m -66.3 -39.87 89.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.903 -1.123 . . . . 1.04 110.004 -178.499 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.68 -50.04 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.819 -1.178 . . . . 1.04 107.819 178.715 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.7 t-20 -60.01 -34.91 73.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.507 -0.923 . . . . 1.09 108.507 178.868 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -68.02 -40.04 83.02 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.581 -0.7 . . . . 2.21 110.368 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.2 mt -99.46 -2.03 37.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.32 -0.862 . . . . 1.05 111.451 -178.656 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 7.7 p . . . . . 0 N--CA 1.498 1.965 0 O-C-N 120.568 -1.333 . . . . 1.08 109.298 179.935 . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo . . . . . 0 N--CA 1.498 1.786 0 CA-C-O 121.239 0.433 . . . . 1.75 111.694 . . . . . . . . . 0 0 . 1 . 024 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.46 120.29 35.44 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.199 -0.938 . . . . 1.35 109.537 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.403 ' O ' ' O ' ' B' ' 64' ' ' ILE . 27.4 m -104.21 127.51 51.83 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.404 -0.81 . . . . 1.36 109.614 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.7 mt -68.31 -32.43 72.56 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.445 -0.785 . . . . 1.24 109.448 179.102 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -61.58 -19.75 62.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.421 -0.8 . . . . 1.89 109.614 -178.869 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.403 ' O ' ' O ' ' B' ' 61' ' ' THR . 33.2 mm -131.9 142.06 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.776 -0.577 . . . . 1.03 109.89 -179.101 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 17.9 m -99.7 125.26 45.54 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.937 -1.505 . . . . 0.19 106.937 177.157 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 69.5 m -77.99 140.89 39.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.897 -1.127 . . . . 0.93 110.386 -178.415 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.471 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.1 m95 -75.06 -10.13 59.18 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.183 -0.948 . . . . 0.21 109.252 179.785 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.51 -12.37 0.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.334 -0.854 . . . . 0.49 108.862 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.471 ' H ' ' C ' ' B' ' 67' ' ' TRP . 14.6 m -63.77 143.29 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.385 -0.822 . . . . 1.66 109.485 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -59.98 -37.19 78.93 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.131 -0.981 . . . . 1.36 109.127 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.992 0 N-CA-C 109.251 -1.539 . . . . 2.32 109.251 -179.811 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.482 -0.562 . . . . 3.32 109.482 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.5 t -98.96 148.4 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.367 -0.833 . . . . 1.16 110.024 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -130.05 129.41 43.6 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 108.355 -0.98 . . . . 2.18 108.355 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -98.66 124.97 43.79 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.246 -0.909 . . . . 0.4 108.727 178.667 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.1 mm -103.38 113.28 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.551 -0.907 . . . . 1.04 108.551 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -98.26 0.0 44.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.316 -0.865 . . . . 2.25 110.04 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -151.63 155.42 38.35 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.042 -1.036 . . . . 0.91 111.217 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.414 ' HZ3' ' HB3' ' A' ' 8' ' ' LYS . 9.8 ttpp -64.82 -31.87 73.3 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.491 -0.929 . . . . 2.18 108.491 178.321 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 93.5 m -57.44 -49.82 75.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.996 . . . . 1.03 109.465 -179.472 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.95 -29.58 67.84 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 119.416 -0.914 . . . . 1.02 108.863 179.015 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 49.1 t80 -59.78 -44.04 94.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.177 -0.952 . . . . 0.15 109.518 179.988 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -64.74 -43.08 94.5 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.542 -0.91 . . . . 2.07 108.542 -179.788 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.04 -37.5 87.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.762 -0.586 . . . . 1.77 110.171 179.468 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.48 -41.26 84.87 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.089 -1.007 . . . . 1.04 108.949 -179.089 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 82.4 mt -60.24 -39.85 88.17 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.188 -0.945 . . . . 1.07 108.828 179.239 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.55 -36.3 76.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.53 -0.731 . . . . 1.07 110.335 -179.555 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.39 -35.93 76.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.316 -0.865 . . . . 1.07 110.512 -178.725 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.35 -30.95 71.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.106 -0.996 . . . . 1.03 109.301 -179.697 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.22 -125.85 24.88 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.465 -1.454 . . . . 0.24 109.465 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -92.17 5.16 51.42 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.294 -1.121 . . . . 1.07 110.729 -179.304 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.69 148.88 40.16 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.79 -1.194 . . . . 2.03 108.947 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.629 ' N ' ' HZ1' ' A' ' 81' ' ' LYS . 0.6 OUTLIER -59.82 159.82 8.42 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 106.638 -1.616 . . . . 1.23 106.638 -179.973 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.497 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 78.8 t -147.35 111.06 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 120.75 -1.219 . . . . 1.03 108.937 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -101.34 144.16 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.255 -1.017 . . . . 1.03 108.255 179.526 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.2 t -126.66 121.66 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.333 -0.854 . . . . 1.01 109.52 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.7 t70 -99.28 119.94 38.74 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.284 -0.885 . . . . 1.05 110.051 179.499 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -95.52 21.96 7.62 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.145 -0.972 . . . . 0.73 109.645 178.92 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.403 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 52.9 m -55.81 147.86 18.05 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.818 -1.176 . . . . 0.84 110.305 -178.587 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -86.56 126.59 34.58 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.174 -1.047 . . . . 1.04 108.174 179.422 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -67.91 -30.21 69.48 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.207 -0.997 . . . . 1.08 109.191 -179.462 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 59.2 p-90 -75.79 -18.06 59.64 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.076 -1.05 . . . . 0.29 110.15 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.0 t -83.8 121.64 27.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.979 -1.075 . . . . 0.26 108.402 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.39 -55.03 28.01 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 121.518 -0.739 . . . . 0.28 112.534 -178.005 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.8 Cg_endo -60.7 -29.93 89.35 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 119.412 1.606 . . . . 0.5 112.09 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.61 -49.76 20.41 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.118 -1.067 . . . . 1.04 108.118 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.37 -32.35 71.21 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.158 -1.053 . . . . 2.12 108.158 177.962 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -57.88 -28.04 63.82 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.007 -0.542 . . . . 2.66 110.112 -179.334 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.9 mt -85.25 -0.92 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.458 -0.776 . . . . 1.22 111.573 -178.926 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.74 -30.75 6.84 Favored Pre-proline 0 C--N 1.302 -1.497 0 O-C-N 120.263 -1.523 . . . . 1.44 113.045 -178.768 . . . . . . . . 3 3 . 1 . 025 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.7 Cg_exo -59.7 -44.21 33.04 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 121.542 1.586 . . . . 0.31 112.91 -178.124 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -69.54 -45.38 68.93 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 118.36 -1.336 . . . . 0.45 108.948 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -61.31 -52.29 65.32 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.988 -1.07 . . . . 0.16 109.701 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -68.07 -42.49 80.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.536 -0.727 . . . . 0.35 111.548 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.1 m -62.74 -39.87 95.46 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.882 -1.136 . . . . 0.77 110.79 -179.202 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.5 mt -61.32 -23.78 65.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.331 -0.856 . . . . 1.07 110.755 -178.338 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.8 m -54.27 -35.32 62.41 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.094 -1.004 . . . . 0.87 109.009 -178.89 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -88.3 -13.0 41.92 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.082 -1.011 . . . . 2.16 108.734 179.183 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -80.52 -37.51 31.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.445 -1.317 . . . . 2.29 107.445 178.408 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.438 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 72.7 m-85 -121.9 68.2 0.92 Allowed 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.986 -1.487 . . . . 0.95 106.986 178.138 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.1 p -64.01 -9.71 17.49 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 108.492 -0.929 . . . . 0.89 108.492 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -90.47 7.73 37.42 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.312 -0.996 . . . . 1.13 108.312 178.805 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 45.7 t -127.23 143.32 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 107.415 -1.328 . . . . 1.06 107.415 178.819 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.1 mm -99.78 124.13 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.097 -1.002 . . . . 1.04 109.501 -178.516 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 40.0 m-85 -104.15 127.31 51.74 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.333 -0.855 . . . . 0.13 109.503 179.188 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.46 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.6 mp -110.42 139.86 45.21 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.3 -0.875 . . . . 1.08 109.218 178.239 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -110.06 130.34 55.55 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 106.982 -1.488 . . . . 1.13 106.982 178.164 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.4 t -128.28 134.04 65.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.354 -0.841 . . . . 1.03 110.74 -177.834 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 59.0 t0 -95.86 119.43 34.34 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.011 -0.737 . . . . 1.05 109.011 179.45 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.23 -16.38 20.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.476 -1.39 . . . . 1.04 108.39 179.223 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.85 -41.47 9.62 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 1.08 111.261 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 25.6 m-20 -95.74 -22.2 17.68 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.844 -1.16 . . . . 1.07 108.747 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -118.46 39.92 3.34 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.866 -1.161 . . . . 1.03 107.866 179.534 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -60.08 -22.1 62.31 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.785 -0.572 . . . . 1.92 110.059 -178.469 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.5 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.701 -1.249 . . . . 1.05 109.196 179.665 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.5 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.5 t -73.68 -43.99 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.05 -1.031 . . . . 1.1 109.395 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.91 75.77 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.54 -0.725 . . . . 1.03 110.477 -178.743 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.8 p -60.77 -33.45 72.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.011 -1.056 . . . . 0.89 109.129 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -62.07 -39.87 93.87 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.406 -0.809 . . . . 2.06 109.438 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.76 1.34 55.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.313 -0.867 . . . . 1.05 111.162 -178.318 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 55.07 49.64 17.08 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.253 -0.905 . . . . 2.02 109.034 -179.291 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.78 130.7 28.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.41 -1.33 . . . . 1.05 107.41 -179.504 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -102.88 -12.12 17.76 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.624 -0.673 . . . . 2.16 109.998 -178.779 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.461 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.45 156.3 20.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.845 -1.159 . . . . 1.04 111.26 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -124.6 154.62 69.97 Favored Pre-proline 0 N--CA 1.499 2.01 0 N-CA-C 108.133 -1.062 . . . . 1.04 108.133 178.933 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -77.32 145.52 80.59 Favored 'Cis proline' 0 N--CA 1.492 1.406 0 C-N-CA 123.542 -1.441 . . . . 0.19 112.359 -3.115 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.41 131.1 48.47 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 108.564 -0.902 . . . . 1.04 108.564 178.125 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.547 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 89.8 m-85 -109.84 130.16 55.56 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.631 -0.668 . . . . 0.23 109.455 -179.207 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.2 mt-30 -120.63 140.45 51.54 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.41 -0.807 . . . . 0.43 109.04 179.104 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.9 131.97 53.95 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 121.117 0.484 . . . . 0.17 110.077 -179.341 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -124.84 145.83 49.58 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.492 0.663 . . . . 0.17 109.432 179.439 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.629 ' HZ1' ' N ' ' A' ' 22' ' ' LEU . 43.8 tptt -146.27 127.35 14.65 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.325 -1.361 . . . . 2.18 107.325 179.954 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.1 mttt 54.95 33.25 19.69 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.319 -0.863 . . . . 1.8 110.072 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.9 21.5 76.29 Favored Glycine 0 N--CA 1.491 2.312 0 O-C-N 120.913 -1.117 . . . . 0.23 110.921 178.899 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -131.02 141.51 50.23 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.209 -1.171 . . . . 2.75 109.786 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -77.67 126.84 31.49 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.98 -1.075 . . . . 2.3 109.51 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.0 m -122.25 12.1 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.766 -0.584 . . . . 1.06 110.187 -179.472 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.33 152.04 10.72 Favored Glycine 0 N--CA 1.493 2.447 0 C-N-CA 118.681 -1.723 . . . . 0.22 111.268 179.645 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.5 tp10 -163.04 137.49 6.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.819 -0.812 . . . . 1.93 109.451 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.483 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.2 p90 -163.37 158.82 21.68 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.591 -0.844 . . . . 0.16 109.976 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -125.97 161.66 27.0 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-O 121.326 0.584 . . . . 0.9 109.792 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.6 141.71 5.89 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.639 -1.384 . . . . 0.12 109.639 179.36 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -79.59 67.28 5.3 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.134 -1.216 . . . . 1.04 109.669 -179.932 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 99.01 6.36 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 108.684 -0.858 . . . . 1.36 108.684 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -35.03 75.26 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.157 -0.964 . . . . 1.6 111.479 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -64.13 -30.04 71.12 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.992 -1.067 . . . . 1.61 109.657 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.96 -37.4 82.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.693 -0.63 . . . . 2.02 109.612 -179.643 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.3 mt -58.77 -38.49 78.6 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.438 -0.949 . . . . 1.05 108.438 179.672 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.438 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 45.1 tp10 -63.99 -40.68 96.91 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 120.252 -0.579 . . . . 2.1 110.748 -178.444 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.09 -43.92 73.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.082 -1.011 . . . . 1.06 111.651 -178.567 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.29 -40.01 93.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.759 -1.213 . . . . 1.04 109.923 -178.777 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.36 -51.63 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.255 -0.903 . . . . 1.04 108.982 -179.733 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.3 t30 -60.33 -34.24 73.54 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.334 -0.988 . . . . 1.09 108.334 179.29 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -68.05 -39.91 82.91 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.611 -0.681 . . . . 2.21 110.426 -178.823 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.8 mt -99.58 -1.98 36.82 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.284 -0.885 . . . . 1.05 110.971 -178.666 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.667 -1.271 . . . . 1.08 109.3 -179.776 . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo . . . . . 0 N--CA 1.494 1.547 0 CA-C-O 121.247 0.436 . . . . 1.75 112.114 . . . . . . . . . 0 0 . 1 . 025 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.3 124.2 33.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.228 -0.92 . . . . 1.35 108.924 179.229 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 24.3 m -108.39 130.2 55.23 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.462 -0.774 . . . . 1.36 109.124 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.42 -30.02 69.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.277 -0.889 . . . . 1.24 109.892 -179.742 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -59.32 -22.02 60.62 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.963 -0.754 . . . . 1.89 108.963 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.6 mm -128.41 140.34 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.558 -0.534 . . . . 1.03 109.558 -179.68 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.5 m -100.58 124.63 46.42 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 107.102 -1.444 . . . . 0.19 107.102 178.002 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -75.51 140.04 42.55 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.94 -1.1 . . . . 0.93 111.468 -177.873 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.477 ' C ' ' H ' ' B' ' 69' ' ' VAL . 19.8 m95 -75.42 -10.23 59.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.21 108.807 178.779 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -51.28 -12.57 0.15 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.582 -0.895 . . . . 0.49 108.582 179.319 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.477 ' H ' ' C ' ' B' ' 67' ' ' TRP . 18.3 m -63.27 146.05 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.464 -0.773 . . . . 1.66 109.659 179.822 . . . . . . . . 2 2 . 1 . 025 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -60.28 -39.88 88.41 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.188 -0.945 . . . . 1.36 109.887 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 CA-C-O 118.101 -1.388 . . . . 2.32 109.724 -179.371 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 mmt . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.475 -0.565 . . . . 3.32 109.475 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . 0.418 ' CG1' ' N ' ' A' ' 3' ' ' LYS . 92.7 t -99.42 161.98 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.56 -0.712 . . . . 1.16 109.838 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . 0.418 ' N ' ' CG1' ' A' ' 2' ' ' VAL . 28.0 tptp -130.09 129.83 44.08 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 108.521 -0.918 . . . . 2.18 108.521 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -98.6 124.14 43.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.493 -0.755 . . . . 0.4 109.429 179.784 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.439 HG22 HD11 ' A' ' 5' ' ' ILE . 31.2 mm -100.26 113.98 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 108.329 -0.989 . . . . 1.04 108.329 178.976 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -98.65 -0.52 42.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 2.25 109.689 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -155.25 157.89 37.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.057 -1.027 . . . . 0.91 110.948 179.782 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -65.16 -30.96 71.92 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.777 -1.194 . . . . 2.18 107.777 178.43 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.8 m -58.98 -47.36 85.44 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.327 -0.858 . . . . 1.03 108.941 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.1 -29.76 68.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.697 -0.853 . . . . 1.02 108.697 178.702 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -59.72 -44.78 93.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.227 -0.92 . . . . 0.15 109.259 -179.683 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -64.27 -43.65 94.19 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 121.809 0.814 . . . . 2.07 108.992 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.17 -37.36 87.12 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.341 0.591 . . . . 1.77 110.804 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.74 82.88 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.34 -0.85 . . . . 1.04 108.891 -179.373 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 63.3 mt -60.55 -40.2 90.71 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.352 -0.843 . . . . 1.07 108.791 179.638 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.26 -32.53 70.39 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.379 -0.825 . . . . 1.07 109.829 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.44 79.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.298 -0.876 . . . . 1.07 109.768 -179.078 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.83 76.36 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 1.03 109.317 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.89 -123.92 16.3 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.963 -1.255 . . . . 0.24 109.963 -179.734 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.42 2.3 54.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.971 -1.311 . . . . 1.07 110.589 -178.876 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -74.45 148.45 41.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.84 -1.162 . . . . 2.03 109.169 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.474 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -60.37 159.4 10.22 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.773 -1.566 . . . . 1.23 106.773 179.708 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.474 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 88.7 t -146.93 113.49 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 120.78 -1.2 . . . . 1.03 108.983 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -101.35 141.75 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 107.964 -1.125 . . . . 1.03 107.964 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.0 t -124.58 120.62 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.397 -0.814 . . . . 1.01 109.377 -179.226 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.7 t70 -99.47 118.66 36.56 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.418 -0.801 . . . . 1.05 110.447 179.595 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -95.06 24.15 5.1 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.513 -0.742 . . . . 0.73 109.735 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.4 m -59.0 145.12 43.01 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.993 -1.067 . . . . 0.84 109.671 -178.835 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.33 124.04 31.5 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.462 -1.31 . . . . 1.04 107.462 178.883 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -67.84 -31.79 71.87 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.102 -1.073 . . . . 1.08 108.102 179.838 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.53 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 53.0 p-90 -70.54 -23.04 62.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.745 -0.597 . . . . 0.29 110.584 179.629 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -83.95 116.46 22.81 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.333 -1.358 . . . . 0.26 107.333 179.54 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.54 -50.83 63.55 Favored Glycine 0 N--CA 1.49 2.294 0 C-N-CA 120.514 -0.851 . . . . 0.28 111.503 -177.692 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.8 Cg_exo -54.56 -35.02 84.9 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 CA-C-N 118.518 1.159 . . . . 0.5 112.052 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.69 -47.85 16.14 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.835 . . . . 1.04 109.642 -179.83 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -60.12 -33.13 71.71 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.193 -1.04 . . . . 2.12 108.193 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.9 tpt -59.78 -30.17 68.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.837 -0.539 . . . . 2.66 109.725 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 76.5 mt -83.87 -2.04 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.705 -0.622 . . . . 1.22 110.88 -178.603 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.72 -30.81 7.56 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 120.423 -1.423 . . . . 1.44 113.028 -178.561 . . . . . . . . 3 3 . 1 . 026 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 24.4 Cg_exo -59.93 -42.17 47.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 CA-C-N 121.641 1.622 . . . . 0.31 112.826 -177.549 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -68.52 -45.98 70.79 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 118.628 -1.229 . . . . 0.45 108.767 -179.78 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -63.12 -51.97 64.4 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.977 -1.077 . . . . 0.16 109.572 179.002 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -67.46 -40.1 85.35 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.707 -0.62 . . . . 0.35 111.106 -179.444 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.8 m -63.88 -36.29 83.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.878 -1.139 . . . . 0.77 110.752 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.56 -20.82 65.95 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.212 -0.93 . . . . 1.07 110.656 -177.887 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.1 m -54.93 -36.46 65.29 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.917 -1.114 . . . . 0.87 108.632 -179.648 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.7 mp0 -88.18 -15.95 34.65 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.131 -0.98 . . . . 2.16 109.9 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -79.3 -37.42 37.76 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 107.169 -1.419 . . . . 2.29 107.169 179.147 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.466 ' C ' ' H ' ' A' ' 51' ' ' ASN . 77.6 m-85 -123.77 67.01 1.03 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 107.374 -1.343 . . . . 0.95 107.374 178.169 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.6 p -63.35 -5.72 3.86 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.14 -1.059 . . . . 0.89 108.14 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.466 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.7 t-20 -79.99 -20.41 45.54 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.223 -0.658 . . . . 1.13 109.223 178.647 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 60.8 t -107.01 149.46 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 108.774 -0.824 . . . . 1.06 108.774 -179.577 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.449 HG22 HD11 ' A' ' 53' ' ' ILE . 27.8 mm -99.79 120.0 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.258 -0.901 . . . . 1.04 108.678 -179.27 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 44.2 m-85 -99.63 126.15 45.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.238 -0.914 . . . . 0.13 110.221 179.965 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.477 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.3 mp -111.49 141.59 44.86 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.225 -0.922 . . . . 1.08 109.35 178.78 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -109.23 132.1 54.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 106.853 -1.536 . . . . 1.13 106.853 178.338 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.0 t -127.89 131.09 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.448 -0.782 . . . . 1.03 109.858 -178.052 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.428 ' O ' ' N ' ' A' ' 62' ' ' ALA . 57.5 t0 -94.27 120.31 34.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.436 -0.79 . . . . 1.05 108.898 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.0 m -67.46 -19.52 25.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 120.627 -1.296 . . . . 1.04 108.329 179.203 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.53 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 17.6 m-20 -92.03 -45.04 8.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.509 -0.744 . . . . 1.08 111.726 -179.271 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 18.1 m-20 -93.97 -13.59 26.87 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.566 -1.334 . . . . 1.07 108.195 179.553 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.428 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 36.98 4.51 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.734 -1.21 . . . . 1.03 107.734 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -60.03 -24.43 64.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.687 -0.633 . . . . 1.92 109.645 -178.803 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.538 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -66.67 -38.61 87.17 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.875 -1.141 . . . . 1.05 108.33 178.793 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.538 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.8 t -69.23 -44.54 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.395 -0.816 . . . . 1.1 109.626 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.56 -37.22 68.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.371 -0.831 . . . . 1.03 110.726 -178.664 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -60.24 -37.41 80.27 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.165 -0.959 . . . . 0.89 109.753 -178.785 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.07 -38.68 92.16 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.342 -0.849 . . . . 2.06 109.26 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -84.74 -1.46 56.28 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.47 -0.769 . . . . 1.05 111.014 -178.816 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 53.84 48.29 21.66 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.027 -1.046 . . . . 2.02 109.596 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.8 t -63.22 134.37 28.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 C-N-CA 118.787 -1.165 . . . . 1.05 108.142 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -106.92 -12.3 15.5 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.563 -0.71 . . . . 2.16 109.797 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.458 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.31 154.53 19.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 1.04 110.911 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -127.62 154.5 77.69 Favored Pre-proline 0 N--CA 1.496 1.864 0 N-CA-C 107.726 -1.212 . . . . 1.04 107.726 178.611 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.6 143.25 73.75 Favored 'Cis proline' 0 N--CA 1.489 1.248 0 C-N-CA 123.57 -1.429 . . . . 0.19 112.569 -2.183 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.458 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.5 m -128.37 133.84 48.72 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.869 -0.789 . . . . 1.04 108.869 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.519 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.1 m-85 -110.71 131.02 55.41 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.632 -0.877 . . . . 0.23 108.632 -179.413 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -122.47 140.19 53.02 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.533 -0.914 . . . . 0.43 108.533 179.429 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -106.63 132.94 52.05 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.377 0.608 . . . . 0.17 109.931 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -126.87 145.68 50.57 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 109.013 -0.736 . . . . 0.17 109.013 179.248 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -145.86 129.41 16.99 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 106.938 -1.505 . . . . 2.18 106.938 179.26 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.4 mttt 56.55 27.96 13.15 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.241 -0.912 . . . . 1.8 108.594 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.94 25.02 67.83 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.689 -1.364 . . . . 0.23 109.689 -179.75 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.412 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.4 mm100 -128.69 136.18 50.26 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.394 -1.062 . . . . 2.75 110.362 -179.82 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -79.38 128.15 32.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.236 -0.915 . . . . 2.3 109.654 179.461 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.4 m -123.93 3.98 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.76 -0.587 . . . . 1.06 110.377 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.22 155.89 17.1 Favored Glycine 0 N--CA 1.496 2.639 0 C-N-CA 118.648 -1.739 . . . . 0.22 111.506 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -164.04 148.7 10.21 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.865 -0.785 . . . . 1.93 109.482 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.436 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 6.3 p90 -164.37 157.33 17.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.613 -0.835 . . . . 0.16 109.913 178.218 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.2 p -125.8 160.41 29.89 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.391 0.615 . . . . 0.9 109.673 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.01 141.7 5.84 Favored Glycine 0 N--CA 1.487 2.052 0 N-CA-C 109.125 -1.59 . . . . 0.12 109.125 -179.91 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.01 65.76 2.1 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.378 -1.072 . . . . 1.04 109.57 -179.972 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 96.98 5.39 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.217 -0.927 . . . . 1.36 108.567 179.062 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -31.95 70.25 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.12 -0.988 . . . . 1.6 111.722 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.28 -29.85 70.93 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.793 -1.192 . . . . 1.61 108.914 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.04 -35.73 77.68 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.705 -0.622 . . . . 2.02 109.403 -179.434 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 56.3 mt -59.88 -39.86 86.76 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.136 0.97 . . . . 1.05 108.508 179.252 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -61.99 -43.76 98.16 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.755 -0.657 . . . . 2.1 111.087 -177.677 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.93 -44.1 73.74 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.035 -1.041 . . . . 1.06 111.659 -178.323 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -66.13 -40.2 90.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.87 -1.144 . . . . 1.04 110.165 -178.444 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.36 -50.11 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.036 -1.04 . . . . 1.04 108.548 179.351 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 24.9 t-20 -59.94 -36.39 76.95 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.905 0.86 . . . . 1.09 108.846 179.209 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -67.72 -39.9 84.28 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.812 -0.555 . . . . 2.21 109.846 -178.644 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.8 mt -97.56 -4.53 37.58 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.152 -0.968 . . . . 1.05 111.267 -179.201 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.0 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 120.411 -1.431 . . . . 1.08 109.285 -179.48 . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.492 1.423 0 CA-C-O 121.081 0.367 . . . . 1.75 112.534 . . . . . . . . . 0 0 . 1 . 026 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.95 130.25 38.18 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.901 -1.124 . . . . 1.35 109.744 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.415 HG21 ' H ' ' B' ' 63' ' ' LYS . 22.7 m -105.75 131.81 52.64 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.541 -0.725 . . . . 1.36 109.71 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.65 -30.12 69.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.238 -0.914 . . . . 1.24 109.302 179.508 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.415 ' H ' HG21 ' B' ' 61' ' ' THR . 41.2 mmtm -61.22 -11.42 9.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.129 -0.693 . . . . 1.89 109.129 -179.486 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 32.1 mm -130.04 140.27 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 122.045 -0.409 . . . . 1.03 110.232 -179.339 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 27.8 m -98.9 130.54 45.3 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 177.497 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.1 m -81.25 144.79 31.31 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.721 -1.237 . . . . 0.93 110.875 -178.189 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.46 ' C ' ' H ' ' B' ' 69' ' ' VAL . 25.0 m95 -79.72 -15.49 57.42 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.236 -0.915 . . . . 0.21 109.53 178.727 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -59.08 -10.98 3.03 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.465 -1.309 . . . . 0.49 107.465 179.126 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.46 ' H ' ' C ' ' B' ' 67' ' ' TRP . 7.6 p -64.79 141.44 18.22 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.093 -0.706 . . . . 1.66 109.093 179.922 . . . . . . . . 2 2 . 1 . 026 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -60.0 -37.33 79.38 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.282 -0.886 . . . . 1.36 109.205 -179.232 . . . . . . . . 1 1 . 1 . 026 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.222 -1.551 . . . . 2.32 109.222 -179.891 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 mmt . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.26 0.553 . . . . 3.32 109.528 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.0 t -99.34 145.42 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.489 -0.757 . . . . 1.16 109.386 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -130.0 128.28 41.71 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.272 -0.893 . . . . 2.18 109.037 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -96.56 125.45 41.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.403 -0.811 . . . . 0.4 109.075 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.414 HG22 HD11 ' A' ' 5' ' ' ILE . 45.3 mm -100.32 111.26 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 N-CA-C 108.517 -0.92 . . . . 1.04 108.517 179.348 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.498 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 54.1 mp0 -98.88 -1.16 40.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.176 -0.952 . . . . 2.25 108.613 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -155.17 156.91 36.55 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.366 -0.834 . . . . 0.91 110.378 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 15.4 ttmm -62.92 -33.37 75.2 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.195 -1.039 . . . . 2.18 108.195 178.509 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.0 m -53.59 -49.51 67.63 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.524 -0.87 . . . . 1.03 109.213 -178.55 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -30.48 69.37 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.334 -0.854 . . . . 1.02 109.165 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.0 t80 -58.49 -45.28 89.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.897 -1.127 . . . . 0.15 108.927 -179.478 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -64.88 -41.78 95.36 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.484 -0.76 . . . . 2.07 109.134 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.73 -39.72 94.12 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 1.77 110.819 -179.763 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.59 82.08 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.044 -1.035 . . . . 1.04 109.016 -179.31 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 72.6 mt -60.22 -41.71 93.65 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.938 -1.134 . . . . 1.07 107.938 179.165 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.49 -37.02 77.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.572 -0.705 . . . . 1.07 110.273 179.813 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.24 -39.64 82.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 1.07 110.429 -179.203 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.23 -27.91 69.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.91 . . . . 1.03 108.952 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.04 -126.36 28.78 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.625 -1.39 . . . . 0.24 109.625 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -90.69 4.52 51.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.118 -1.225 . . . . 1.07 110.059 -179.192 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 26.7 mtpp -74.75 150.52 39.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.873 -1.142 . . . . 2.03 109.079 -179.846 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.504 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -59.62 159.5 8.41 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.511 -1.292 . . . . 1.23 107.511 -179.253 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.504 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 61.8 t -147.25 116.89 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 120.993 -1.067 . . . . 1.03 108.3 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.31 144.01 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.211 -1.033 . . . . 1.03 108.211 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.4 t -125.24 123.78 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.38 -0.825 . . . . 1.01 109.938 -179.322 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -100.98 120.16 39.77 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.28 -0.888 . . . . 1.05 110.075 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -95.87 22.41 7.41 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.925 -1.109 . . . . 0.73 110.107 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -58.12 149.0 24.81 Favored 'General case' 0 C--N 1.296 -1.745 0 O-C-N 120.969 -1.082 . . . . 0.84 110.494 -178.057 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.59 124.18 31.85 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.963 -1.125 . . . . 1.04 107.963 179.389 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -65.18 -32.07 73.57 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 118.78 -1.168 . . . . 1.08 108.21 -179.795 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.524 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 51.9 p-90 -72.38 -24.37 61.25 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.326 -0.859 . . . . 0.29 111.495 179.672 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -82.8 116.65 22.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.584 -1.322 . . . . 0.26 109.304 -178.741 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.442 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.12 -51.98 54.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 111.267 -0.733 . . . . 0.28 111.267 -178.753 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.6 Cg_exo -50.98 -34.97 48.5 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 CA-C-N 118.776 1.288 . . . . 0.5 111.673 179.518 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.8 -47.45 15.17 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.39 -0.818 . . . . 1.04 109.637 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.74 -33.14 71.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.06 -1.025 . . . . 2.12 108.863 179.141 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 23.5 ttt -58.34 -26.21 62.84 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.516 -0.74 . . . . 2.66 109.969 179.366 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.7 mt -86.27 -2.36 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.406 -0.809 . . . . 1.22 111.14 -178.705 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.553 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -63.38 -30.56 5.51 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 120.187 -1.571 . . . . 1.44 113.298 -177.533 . . . . . . . . 3 3 . 1 . 027 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 29.3 Cg_exo -60.15 -41.27 53.03 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 CA-C-N 121.492 1.569 . . . . 0.31 112.375 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -68.63 -48.52 63.86 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.797 -1.189 . . . . 0.45 109.534 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -60.91 -51.94 67.14 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.154 -0.967 . . . . 0.16 109.151 179.046 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -65.72 -43.31 89.48 Favored 'General case' 0 C--N 1.292 -1.892 0 O-C-N 121.691 -0.63 . . . . 0.35 110.747 179.634 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.484 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.5 m -62.77 -39.49 94.35 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.829 -1.169 . . . . 0.77 111.392 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.7 -20.06 63.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.97 -1.082 . . . . 1.07 110.159 -178.201 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.5 m -53.98 -39.71 66.26 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.974 -1.09 . . . . 0.87 108.284 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -83.07 -18.16 40.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.044 -1.035 . . . . 2.16 109.867 178.856 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -76.85 -35.69 57.34 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.244 -1.391 . . . . 2.29 107.244 179.597 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -123.8 67.11 1.03 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.405 -1.332 . . . . 0.95 107.405 178.183 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.3 p -64.28 -10.42 23.78 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 108.868 -0.79 . . . . 0.89 108.868 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -90.23 8.45 33.09 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.04 -1.096 . . . . 1.13 108.04 179.161 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.16 143.65 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 107.483 -1.303 . . . . 1.06 107.483 178.598 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.428 HG22 HD11 ' A' ' 53' ' ' ILE . 27.7 mm -98.99 121.22 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.222 -0.924 . . . . 1.04 109.614 -178.375 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 49.3 m-85 -99.15 127.88 45.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.13 109.403 179.392 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.408 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 2.8 mp -111.7 146.36 37.65 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.349 -0.845 . . . . 1.08 109.333 178.903 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -116.04 129.83 56.54 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.775 -1.565 . . . . 1.13 106.775 177.778 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.8 t -126.79 132.78 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 CA-C-O 121.547 0.689 . . . . 1.03 109.827 -178.359 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 53.7 t0 -97.98 118.92 35.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.535 -0.913 . . . . 1.05 108.535 179.626 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.2 m -65.57 -20.87 28.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 120.252 -1.53 . . . . 1.04 108.247 179.292 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.524 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 3.4 m-20 -92.14 -41.51 10.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.517 -0.739 . . . . 1.08 112.406 -177.982 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 65.6 m-20 -95.49 -20.98 18.61 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.402 -1.436 . . . . 1.07 108.437 179.223 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.98 43.42 2.79 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 108.238 -1.023 . . . . 1.03 108.238 179.258 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -61.56 -19.3 62.01 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.615 -0.678 . . . . 1.92 109.645 -179.144 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.431 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.5 p30 -62.8 -40.47 97.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.105 -0.997 . . . . 1.05 109.583 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.431 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 22.2 t -72.31 -43.45 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.244 -0.91 . . . . 1.1 109.69 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.49 -39.16 74.33 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.647 -0.658 . . . . 1.03 111.371 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -61.21 -36.0 78.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.983 -1.073 . . . . 0.89 109.191 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -64.97 -39.67 93.84 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.527 -0.733 . . . . 2.06 109.24 179.508 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.15 -3.2 58.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 1.05 110.791 -178.987 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 55.51 50.31 14.88 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.002 -1.062 . . . . 2.02 109.746 -179.709 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.62 134.03 28.91 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 C-N-CA 118.627 -1.229 . . . . 1.05 108.63 -179.049 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -105.0 -12.72 16.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.67 -0.644 . . . . 2.16 110.23 -179.197 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.43 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 155.55 20.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.908 -1.12 . . . . 1.04 110.92 179.526 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.1 p -128.91 154.45 80.2 Favored Pre-proline 0 N--CA 1.499 1.983 0 N-CA-C 107.455 -1.313 . . . . 1.04 107.455 178.582 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -76.91 143.17 74.92 Favored 'Cis proline' 0 N--CA 1.492 1.43 0 C-N-CA 123.985 -1.256 . . . . 0.19 112.854 -1.565 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.423 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.0 m -130.0 134.75 47.63 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.044 -0.724 . . . . 1.04 109.044 178.55 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -110.58 130.16 55.63 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.378 0.608 . . . . 0.23 109.777 -179.385 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -120.98 139.94 52.58 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 108.189 -1.041 . . . . 0.43 108.189 179.29 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -105.84 134.97 48.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.669 -0.644 . . . . 0.17 110.126 -178.94 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -129.45 145.85 51.37 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.709 0.766 . . . . 0.17 109.577 179.266 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -149.09 131.18 15.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.372 -1.714 . . . . 2.18 106.372 179.072 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.6 mttt 57.33 30.08 17.92 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.186 -0.946 . . . . 1.8 109.575 -178.766 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.56 18.31 79.84 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.451 -1.06 . . . . 0.23 110.451 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -127.52 142.88 51.27 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.388 -1.066 . . . . 2.75 109.654 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -80.06 131.55 35.79 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.432 -0.792 . . . . 2.3 109.324 179.572 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.1 m -121.8 11.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.814 -0.554 . . . . 1.06 110.374 -179.638 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 167.49 161.54 17.18 Favored Glycine 0 N--CA 1.498 2.805 0 C-N-CA 118.42 -1.848 . . . . 0.22 112.012 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -165.32 149.23 8.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.872 -0.781 . . . . 1.93 110.198 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 12.1 p90 -162.84 160.59 25.3 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.078 -1.014 . . . . 0.16 109.135 177.876 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.29 164.9 20.0 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 121.492 0.663 . . . . 0.9 109.932 -178.914 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.74 142.38 6.68 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.072 -1.611 . . . . 0.12 109.072 179.862 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.78 62.96 3.41 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.272 -1.134 . . . . 1.04 109.495 -179.82 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.72 97.37 5.94 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.475 -0.766 . . . . 1.36 109.015 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -32.66 72.4 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.332 -0.855 . . . . 1.6 111.265 -179.704 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.87 -30.04 71.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.044 -1.035 . . . . 1.61 109.934 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -61.23 -35.95 78.64 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.626 0.727 . . . . 2.02 109.206 -179.1 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.9 mt -59.52 -39.43 83.84 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 122.253 1.025 . . . . 1.05 108.968 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -62.43 -43.07 99.69 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 119.824 -0.75 . . . . 2.1 110.745 -177.797 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.15 69.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.951 -1.093 . . . . 1.06 111.031 -178.867 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.3 m -63.97 -40.16 95.77 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 1.04 109.874 -178.714 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.7 mt -61.29 -50.02 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 N-CA-C 107.849 -1.167 . . . . 1.04 107.849 178.784 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -60.26 -35.08 74.68 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.693 -0.855 . . . . 1.09 108.693 178.945 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -67.65 -38.57 84.0 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.418 -0.801 . . . . 2.21 109.881 -178.639 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 84.0 mt -99.21 -4.16 32.68 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.065 -1.022 . . . . 1.05 111.405 -179.463 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.496 1.868 0 O-C-N 120.538 -1.351 . . . . 1.08 109.164 -179.177 . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo . . . . . 0 N--CA 1.493 1.494 0 CA-C-O 121.312 0.463 . . . . 1.75 112.204 . . . . . . . . . 0 0 . 1 . 027 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -90.8 125.46 35.72 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.205 -0.934 . . . . 1.35 109.387 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.432 ' O ' ' O ' ' B' ' 64' ' ' ILE . 59.0 m -110.41 130.37 55.57 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.34 -0.85 . . . . 1.36 109.375 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.4 -32.19 73.69 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.153 -0.967 . . . . 1.24 109.949 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt -64.18 -19.99 65.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.215 -0.928 . . . . 1.89 109.536 -179.134 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.432 ' O ' ' O ' ' B' ' 61' ' ' THR . 35.3 mm -130.28 139.88 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.856 -0.528 . . . . 1.03 110.404 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.6 m -98.17 125.38 43.17 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 107.524 -1.287 . . . . 0.19 107.524 177.334 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -77.93 145.07 36.34 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.831 -1.168 . . . . 0.93 111.689 -178.348 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.474 ' C ' ' H ' ' B' ' 69' ' ' VAL . 24.6 m95 -76.7 -12.02 59.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.805 . . . . 0.21 108.976 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -51.34 -13.05 0.17 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.031 -1.043 . . . . 0.49 108.485 179.654 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.474 ' H ' ' C ' ' B' ' 67' ' ' TRP . 19.0 m -61.33 145.92 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.17 -0.957 . . . . 1.66 109.79 179.781 . . . . . . . . 2 2 . 1 . 027 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -61.01 -37.67 83.35 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.433 -0.792 . . . . 1.36 109.208 -179.423 . . . . . . . . 1 1 . 1 . 027 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.458 0 CA-C-O 117.897 -1.502 . . . . 2.32 109.842 -179.864 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.736 -0.468 . . . . 3.32 109.736 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 69.8 t -97.99 153.71 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.373 -0.83 . . . . 1.16 109.465 -179.526 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -131.33 130.11 42.29 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.382 -0.823 . . . . 2.18 108.889 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -95.96 124.22 39.88 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.888 -1.132 . . . . 0.4 108.595 178.74 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.404 HG22 HD11 ' A' ' 5' ' ' ILE . 31.4 mm -102.0 112.03 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.341 -0.849 . . . . 1.04 109.329 179.57 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.48 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.1 mp0 -97.21 -1.0 45.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.946 . . . . 2.25 109.372 179.836 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -154.87 157.62 38.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.59 -1.319 . . . . 0.91 111.208 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.492 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 34.4 ttmt -63.88 -32.48 74.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.017 -1.105 . . . . 2.18 108.017 177.648 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.4 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 52.1 m -56.28 -46.43 79.74 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.319 -0.952 . . . . 1.03 108.841 -178.82 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.59 -30.25 66.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.256 -0.902 . . . . 1.02 109.166 178.745 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 48.8 t80 -59.86 -43.81 94.47 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.397 -0.815 . . . . 0.15 108.974 -179.025 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -65.55 -42.96 91.31 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.693 0.759 . . . . 2.07 109.819 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -66.52 -39.7 88.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.556 -0.715 . . . . 1.77 110.06 179.638 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.9 96.26 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.304 -0.872 . . . . 1.04 108.696 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 65.4 mt -59.92 -40.25 88.23 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.219 -0.926 . . . . 1.07 108.597 179.673 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -69.39 -36.33 76.68 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.181 -0.95 . . . . 1.07 110.009 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.6 -39.31 84.8 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.343 -0.848 . . . . 1.07 110.516 -178.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -32.45 70.96 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.228 -0.92 . . . . 1.03 108.966 -179.874 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.55 -124.02 17.59 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.968 -1.253 . . . . 0.24 109.968 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -93.43 5.31 52.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.32 -1.106 . . . . 1.07 110.505 -179.073 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -76.55 149.28 36.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.157 -0.964 . . . . 2.03 109.173 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.474 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.31 157.73 13.05 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 106.861 -1.533 . . . . 1.23 106.861 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.474 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 99.5 t -143.95 112.39 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.049 -1.032 . . . . 1.03 108.685 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -100.17 144.68 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 108.443 -0.947 . . . . 1.03 108.443 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.4 t -126.4 121.09 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 O-C-N 121.273 -0.892 . . . . 1.01 109.796 -179.917 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.0 t70 -98.66 120.08 38.49 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.217 -0.927 . . . . 1.05 109.872 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -96.3 23.27 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.342 -0.849 . . . . 0.73 110.059 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.3 m -58.67 147.36 33.06 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.054 -1.029 . . . . 0.84 110.746 -178.788 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.76 125.57 32.68 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 107.94 -1.133 . . . . 1.04 107.94 178.669 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -67.98 -33.91 75.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 118.957 -1.097 . . . . 1.08 108.573 -179.887 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.452 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 57.0 p-90 -70.42 -23.93 62.83 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.322 -0.861 . . . . 0.29 110.387 179.396 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.46 119.83 24.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.599 -1.313 . . . . 0.26 107.486 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -64.7 -51.29 53.09 Favored Glycine 0 N--CA 1.49 2.243 0 C-N-CA 120.3 -0.952 . . . . 0.28 110.737 -178.152 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -51.8 -36.34 62.23 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 118.553 1.176 . . . . 0.5 112.504 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.46 -48.86 16.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.97 . . . . 1.04 109.883 179.918 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.6 -34.91 74.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.119 -0.988 . . . . 2.12 109.465 179.309 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -60.01 -28.95 68.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.568 -0.708 . . . . 2.66 109.955 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 68.2 mt -83.31 -0.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.753 -0.592 . . . . 1.22 110.379 -178.939 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.66 -30.26 6.22 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 120.674 -1.266 . . . . 1.44 113.051 -179.047 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.9 Cg_exo -59.76 -42.9 41.95 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 CA-C-N 121.699 1.643 . . . . 0.31 113.333 -177.507 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -67.91 -47.87 67.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.432 -1.417 . . . . 0.45 108.561 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -59.84 -51.53 69.32 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.296 -0.878 . . . . 0.16 110.104 179.174 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -69.37 -44.42 71.57 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 121.801 -0.562 . . . . 0.35 111.092 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 61.1 m -61.39 -39.96 92.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.147 -0.971 . . . . 0.77 110.332 -179.263 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -59.59 -24.28 63.64 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.12 -0.987 . . . . 1.07 110.113 -178.801 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -51.83 -36.53 48.36 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 120.648 -1.283 . . . . 0.87 108.957 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.7 mp0 -86.14 -14.34 44.41 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.116 -0.99 . . . . 2.16 109.43 179.178 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -80.38 -34.24 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.064 -1.458 . . . . 2.29 107.064 178.049 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -124.79 64.25 1.12 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.372 -1.344 . . . . 0.95 107.372 177.767 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -61.52 -9.7 6.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.542 -0.724 . . . . 0.89 109.27 -179.271 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -91.6 9.83 30.58 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.336 -0.987 . . . . 1.13 108.336 179.216 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 47.8 t -127.39 142.11 44.49 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 N-CA-C 106.683 -1.599 . . . . 1.06 106.683 178.575 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.424 HG22 HD11 ' A' ' 53' ' ' ILE . 26.2 mm -99.79 119.61 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.053 -1.029 . . . . 1.04 109.425 -178.424 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -99.07 124.43 44.07 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.309 -0.87 . . . . 0.13 110.293 179.645 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.463 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.7 mp -109.16 141.43 41.38 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.168 -0.958 . . . . 1.08 109.095 178.855 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -110.02 132.35 54.24 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 106.925 -1.509 . . . . 1.13 106.925 178.101 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.9 t -128.38 132.54 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.476 -0.765 . . . . 1.03 110.416 -177.894 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 27.8 t0 -95.81 119.6 34.58 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.458 -0.776 . . . . 1.05 109.044 179.55 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.59 -16.57 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.469 -1.394 . . . . 1.04 108.598 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.6 m-20 -92.11 -42.91 9.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.449 -0.782 . . . . 1.08 111.506 -178.656 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -97.32 -23.4 16.14 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.869 -1.144 . . . . 1.07 108.638 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -114.08 36.36 3.74 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.828 -1.545 . . . . 1.03 106.828 179.191 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.3 OUTLIER -59.67 -20.53 56.85 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.657 -0.702 . . . . 1.92 110.037 -178.736 . . . . . . . . 3 3 . 1 . 028 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.524 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -67.13 -37.43 83.84 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.98 -1.075 . . . . 1.05 109.201 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.524 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 19.0 t -72.89 -43.54 59.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.212 -0.93 . . . . 1.1 109.279 179.91 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.77 -40.04 72.87 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.71 -0.619 . . . . 1.03 110.849 -178.464 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.2 p -60.98 -35.41 76.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.514 -1.366 . . . . 0.89 108.864 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.492 ' OE2' ' NZ ' ' A' ' 8' ' ' LYS . 36.9 tt0 -62.22 -39.59 93.29 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.448 -0.782 . . . . 2.06 109.401 178.796 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.74 -2.56 58.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.28 -0.887 . . . . 1.05 110.767 -179.299 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 55.57 49.16 17.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.214 -0.929 . . . . 2.02 109.133 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.1 t -62.74 131.83 28.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 C-N-CA 118.267 -1.373 . . . . 1.05 108.397 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -102.85 -12.42 17.57 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.668 -0.645 . . . . 2.16 109.828 -178.983 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.468 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.22 155.93 18.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.704 -1.247 . . . . 1.04 110.588 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -128.47 153.77 79.28 Favored Pre-proline 0 N--CA 1.5 2.071 0 N-CA-C 107.796 -1.187 . . . . 1.04 107.796 178.642 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -76.51 141.07 68.82 Favored 'Cis proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.797 -1.335 . . . . 0.19 113.331 -2.115 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.2 m -125.72 135.16 51.77 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 108.246 -1.02 . . . . 1.04 108.246 177.918 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.519 ' CE2' ' OD1' ' A' ' 26' ' ' ASP . 89.7 m-85 -111.21 132.48 54.29 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.801 -0.815 . . . . 0.23 108.801 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -123.35 141.86 51.55 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.134 -0.979 . . . . 0.43 108.696 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 90.1 m-85 -109.02 131.45 55.06 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.588 0.709 . . . . 0.17 111.19 -178.504 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -126.57 145.66 50.45 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.395 0.617 . . . . 0.17 109.511 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -147.98 130.39 15.73 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.368 -1.345 . . . . 2.18 107.368 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.3 mttt 57.45 29.45 17.02 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.223 -0.923 . . . . 1.8 108.841 -178.893 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.66 18.23 79.17 Favored Glycine 0 N--CA 1.49 2.248 0 C-N-CA 120.026 -1.083 . . . . 0.23 110.557 179.811 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -126.82 140.75 52.13 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.185 -1.185 . . . . 2.75 110.467 179.907 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -79.64 129.73 34.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.412 -0.805 . . . . 2.3 108.869 179.198 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.5 m -125.43 3.91 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.588 -0.695 . . . . 1.06 110.187 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.89 156.97 20.05 Favored Glycine 0 N--CA 1.496 2.634 0 C-N-CA 118.108 -1.996 . . . . 0.22 111.984 -179.477 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -165.99 149.62 7.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.977 -0.719 . . . . 1.93 109.719 179.11 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.432 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 17.6 p90 -164.1 160.85 22.01 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.186 -1.005 . . . . 0.16 109.404 177.447 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -126.02 160.75 29.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.647 -0.658 . . . . 0.9 109.901 -179.614 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 120.91 138.89 5.61 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 108.931 -1.668 . . . . 0.12 108.931 179.885 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.71 65.5 3.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.214 -1.168 . . . . 1.04 110.711 -178.889 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.2 t-20 -118.03 101.66 8.43 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.273 -1.01 . . . . 1.36 108.273 178.109 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.4 -33.2 72.66 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.332 -0.855 . . . . 1.6 111.3 -179.398 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.8 -29.92 71.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.868 -1.145 . . . . 1.61 109.575 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.436 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 79.2 tttt -62.79 -33.99 76.35 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.637 -0.665 . . . . 2.02 109.392 -179.097 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.86 -39.91 86.83 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.53 -0.915 . . . . 1.05 108.53 179.733 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.05 -42.44 99.72 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.428 -0.909 . . . . 2.1 110.523 -178.451 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.38 77.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.949 -1.094 . . . . 1.06 111.123 -178.412 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.5 m -65.98 -39.93 90.76 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.61 -1.306 . . . . 1.04 108.599 -179.822 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.01 -47.0 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.396 -1.335 . . . . 1.04 107.396 177.923 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -60.74 -36.77 79.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.504 -0.924 . . . . 1.09 108.504 179.047 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.27 -39.72 82.07 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.759 -0.588 . . . . 2.21 109.878 -179.174 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.1 mt -98.33 -2.75 38.65 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.429 -0.794 . . . . 1.05 111.661 -178.632 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.9 p . . . . . 0 N--CA 1.499 1.978 0 O-C-N 120.535 -1.353 . . . . 1.08 109.391 -179.119 . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo . . . . . 0 N--CA 1.495 1.562 0 CA-C-O 121.047 0.353 . . . . 1.75 112.3 . . . . . . . . . 0 0 . 1 . 028 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.62 124.04 31.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.053 -1.029 . . . . 1.35 108.777 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 26.9 m -106.12 129.98 54.1 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.478 -0.764 . . . . 1.36 109.225 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.87 -30.11 70.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.373 -0.829 . . . . 1.24 109.67 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.48 -20.32 63.02 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.428 -0.795 . . . . 1.89 109.688 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 33.4 mm -129.88 140.19 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 121.583 -0.698 . . . . 1.03 109.463 -179.776 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 26.8 m -96.38 127.08 42.05 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 106.896 -1.52 . . . . 0.19 106.896 177.853 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.7 m -76.89 141.14 40.68 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.958 -1.089 . . . . 0.93 111.123 -178.042 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.467 ' C ' ' H ' ' B' ' 69' ' ' VAL . 23.7 m95 -77.18 -11.87 59.87 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.009 -1.057 . . . . 0.21 109.32 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . 0.405 ' N ' HD21 ' B' ' 68' ' ' ASN . 2.2 m120 -54.22 -10.94 0.42 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.636 -0.876 . . . . 0.49 108.636 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.467 ' H ' ' C ' ' B' ' 67' ' ' TRP . 19.2 m -65.35 144.13 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.483 -0.761 . . . . 1.66 109.27 179.678 . . . . . . . . 2 2 . 1 . 028 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.45 -39.19 82.79 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.126 -0.984 . . . . 1.36 109.084 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.079 -1.608 . . . . 2.32 109.079 -179.426 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mmm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 108.887 -0.782 . . . . 3.32 108.887 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 79.5 t -99.24 144.3 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.267 -0.896 . . . . 1.16 109.544 -179.833 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 tppt? -129.94 129.17 43.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.414 -0.958 . . . . 2.18 108.414 -179.721 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -98.95 123.07 42.98 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.659 -0.867 . . . . 0.4 108.659 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.6 mm -100.81 114.16 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.761 -0.829 . . . . 1.04 108.761 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.496 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.0 mp0 -97.22 -0.12 47.29 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.241 -0.912 . . . . 2.25 109.751 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.22 156.28 38.21 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.812 -1.18 . . . . 0.91 111.271 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -64.67 -30.92 71.95 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.13 -1.063 . . . . 2.18 108.13 178.323 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -58.21 -49.43 77.09 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.612 -0.835 . . . . 1.03 108.863 -179.246 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -29.48 67.65 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.43 -0.794 . . . . 1.02 109.079 178.994 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.6 t80 -59.71 -44.15 93.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.202 -0.936 . . . . 0.15 109.136 -179.834 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -66.93 -42.94 84.47 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.778 -0.769 . . . . 2.07 108.932 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -64.13 -36.55 84.42 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.519 -0.738 . . . . 1.77 110.352 179.569 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.03 -42.83 79.99 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.375 -0.828 . . . . 1.04 109.061 -179.36 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 80.3 mt -60.86 -39.99 91.22 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -0.876 . . . . 1.07 108.662 179.612 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -69.7 -36.4 75.91 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.425 -0.797 . . . . 1.07 109.632 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.16 -36.82 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.435 -0.791 . . . . 1.07 110.269 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.03 -27.53 69.47 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.139 -0.975 . . . . 1.03 109.534 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.29 -129.47 28.74 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.861 -1.295 . . . . 0.24 109.861 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -93.09 7.53 43.8 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.284 -1.127 . . . . 1.07 110.473 -179.112 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -75.6 149.92 38.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.018 -1.051 . . . . 2.03 109.453 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.418 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.08 153.92 20.57 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 107.216 -1.402 . . . . 1.23 107.216 179.73 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.418 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 63.8 t -143.29 117.38 3.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 121.002 -1.061 . . . . 1.03 108.531 179.954 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.36 139.27 25.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 108.055 -1.091 . . . . 1.03 108.055 179.573 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.5 t -121.68 123.16 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.401 -0.812 . . . . 1.01 108.941 -179.783 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.545 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.9 t70 -102.75 110.01 21.79 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.649 -0.657 . . . . 1.05 110.924 -179.521 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -90.1 103.79 16.43 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.748 -1.575 . . . . 0.73 106.748 176.923 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.433 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 63.8 m -130.02 146.97 51.72 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.705 -0.85 . . . . 0.84 108.705 179.793 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.48 121.6 28.41 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.571 -1.27 . . . . 1.04 107.571 179.259 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -65.69 -32.36 73.88 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 118.514 -1.274 . . . . 1.08 107.618 179.801 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.434 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 60.4 p-90 -70.27 -25.75 63.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.513 -0.742 . . . . 0.29 110.809 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.12 116.85 22.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.812 -1.18 . . . . 0.26 108.458 -179.318 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.453 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.67 -52.0 55.18 Favored Glycine 0 N--CA 1.49 2.262 0 C-N-CA 120.724 -0.75 . . . . 0.28 111.45 -178.425 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -53.23 -33.19 63.87 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 CA-C-N 118.497 1.148 . . . . 0.5 112.183 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.08 -52.76 8.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.208 -0.932 . . . . 1.04 109.865 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -60.13 -36.73 78.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.03 -1.044 . . . . 2.12 109.611 179.645 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 36.7 tpp -59.65 -28.1 66.94 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.457 -0.777 . . . . 2.66 109.914 -179.49 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.415 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 76.9 mt -80.22 -4.01 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 1.22 110.781 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.02 -29.94 6.14 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.371 -1.456 . . . . 1.44 114.47 -177.711 . . . . . . . . 3 3 . 1 . 029 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 39.5 Cg_exo -59.22 -40.55 68.04 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 CA-C-N 122.039 1.764 . . . . 0.31 113.506 -177.452 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -68.1 -47.22 68.8 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 118.295 -1.362 . . . . 0.45 108.74 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.64 -50.77 69.91 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.391 -0.818 . . . . 0.16 109.73 179.126 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -66.77 -41.33 87.9 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.602 -0.686 . . . . 0.35 110.441 -179.517 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.2 m -63.03 -37.73 88.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.236 -0.915 . . . . 0.77 110.652 -179.859 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.07 -25.72 67.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.174 -0.953 . . . . 1.07 110.285 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.6 m -51.44 -39.45 57.4 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.981 -1.075 . . . . 0.87 108.577 -179.359 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -84.48 -16.72 41.49 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.469 -0.769 . . . . 2.16 109.366 179.955 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.604 ' HZ3' ' HH ' ' A' ' 49' ' ' TYR . 61.1 tttm -78.89 -36.62 41.82 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.776 -1.202 . . . . 2.29 108.179 179.659 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.604 ' HH ' ' HZ3' ' A' ' 48' ' ' LYS . 84.2 m-85 -123.96 66.17 1.04 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.008 -1.479 . . . . 0.95 107.008 177.728 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.5 p -61.78 -9.71 7.19 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.279 -0.637 . . . . 0.89 109.279 -179.105 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -89.93 9.1 29.04 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.271 -1.011 . . . . 1.13 108.271 179.044 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.8 t -127.37 144.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 107.688 -1.227 . . . . 1.06 107.688 178.739 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.3 mm -99.92 122.76 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 120.99 -1.068 . . . . 1.04 109.594 -178.152 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 50.5 m-85 -104.21 124.87 49.89 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.175 -0.953 . . . . 0.13 110.203 -179.813 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.476 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.6 mp -111.31 140.34 45.96 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.071 -1.018 . . . . 1.08 109.903 178.804 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -110.48 132.01 54.55 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.019 -1.474 . . . . 1.13 107.019 177.84 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 64.7 t -125.63 136.08 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.464 -0.772 . . . . 1.03 110.847 -177.977 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -97.04 118.85 34.38 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.396 -0.965 . . . . 1.05 108.396 179.332 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.6 m -68.03 -19.21 24.5 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 O-C-N 120.568 -1.333 . . . . 1.04 108.723 179.56 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.434 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 4.7 m-20 -93.68 -42.36 9.21 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.432 -0.793 . . . . 1.08 111.736 -179.232 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 52.8 m-20 -94.13 -15.77 24.38 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.574 -1.329 . . . . 1.07 108.489 179.636 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.83 38.42 4.2 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.505 -1.295 . . . . 1.03 107.505 179.228 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -59.95 -20.21 56.26 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.376 -0.602 . . . . 1.92 109.376 -178.982 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.541 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -63.94 -39.12 93.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.153 -0.967 . . . . 1.05 109.156 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.541 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 21.8 t -73.39 -43.22 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.196 -0.94 . . . . 1.1 108.992 179.634 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.57 -40.05 80.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.528 -0.733 . . . . 1.03 110.935 -178.658 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.5 p -60.07 -37.6 80.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.797 -1.189 . . . . 0.89 108.556 -179.75 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.93 -36.1 82.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.502 -0.749 . . . . 2.06 109.143 178.8 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.94 -2.18 58.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.293 -0.879 . . . . 1.05 111.217 -178.858 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 52.72 49.95 19.19 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.775 -1.203 . . . . 2.02 109.776 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.3 t -64.94 131.99 30.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 C-N-CA 118.826 -1.15 . . . . 1.05 108.534 -179.413 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -104.29 -12.78 16.43 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.694 -0.629 . . . . 2.16 109.73 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.63 155.8 17.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.996 -1.065 . . . . 1.04 110.526 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.0 154.25 81.18 Favored Pre-proline 0 N--CA 1.501 2.112 0 N-CA-C 108.065 -1.087 . . . . 1.04 108.065 178.582 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -76.0 143.92 78.16 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.987 -1.255 . . . . 0.19 112.852 -2.857 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.6 m -128.68 135.9 49.9 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 108.493 -0.929 . . . . 1.04 108.493 178.828 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.545 ' CE2' ' OD1' ' A' ' 26' ' ' ASP . 87.5 m-85 -108.25 129.7 55.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.23 109.187 -179.075 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.3 136.17 54.86 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.164 -1.05 . . . . 0.43 108.164 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -104.57 134.83 47.09 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.417 0.627 . . . . 0.17 110.363 -179.025 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.93 148.95 48.1 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.621 0.724 . . . . 0.17 109.3 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -146.54 122.97 11.02 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.049 -1.463 . . . . 2.18 107.049 179.679 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 74.4 mttt 58.05 27.27 14.63 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.904 -1.147 . . . . 1.8 107.904 -178.403 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.418 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 80.49 11.04 84.58 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.515 -1.034 . . . . 0.23 110.515 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.418 HE21 ' C ' ' A' ' 83' ' ' GLY . 6.4 mm-40 -112.63 134.52 54.11 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.413 -1.051 . . . . 2.75 109.919 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -79.31 123.91 27.9 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.996 -1.113 . . . . 2.3 107.996 178.861 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.4 m -124.79 12.12 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.809 -0.557 . . . . 1.06 110.452 -179.197 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.41 152.44 11.07 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 118.685 -1.721 . . . . 0.22 111.496 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -167.26 148.89 5.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.723 -0.869 . . . . 1.93 109.87 179.254 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.685 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 21.9 p90 -164.02 162.59 23.25 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 119.652 -0.819 . . . . 0.16 109.127 177.209 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -125.38 160.51 29.2 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 121.609 0.719 . . . . 0.9 110.329 -179.014 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 118.61 140.06 6.27 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.47 -1.452 . . . . 0.12 109.47 179.684 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.29 66.95 3.99 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.372 -1.075 . . . . 1.04 111.042 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.98 96.88 5.66 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 106.919 -1.512 . . . . 1.36 106.919 177.861 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -37.49 77.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.565 -0.709 . . . . 1.6 112.705 -177.783 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -63.08 -28.86 70.37 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.888 -1.133 . . . . 1.61 109.572 -179.768 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.685 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 21.0 ttpp -63.93 -33.76 76.44 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.584 -0.698 . . . . 2.02 109.682 -179.032 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 34.2 mt -57.96 -38.91 76.89 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.985 -1.117 . . . . 1.05 107.985 179.036 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -60.47 -42.13 95.61 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 115.629 -0.714 . . . . 2.1 110.014 -178.673 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.08 77.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.182 -0.948 . . . . 1.06 110.958 -179.239 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.34 -39.89 89.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.924 -1.11 . . . . 1.04 109.309 -179.158 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.5 mt -60.91 -49.65 83.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 107.758 -1.201 . . . . 1.04 107.758 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 20.0 t-20 -60.06 -35.42 75.1 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.806 0.813 . . . . 1.09 109.024 178.934 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -67.57 -40.0 84.88 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.523 -0.735 . . . . 2.21 109.986 -178.407 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 97.3 mt -100.16 1.08 41.71 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.224 -0.923 . . . . 1.05 111.605 -178.756 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.468 -1.395 . . . . 1.08 109.87 -179.237 . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo . . . . . 0 N--CA 1.494 1.538 0 CA-C-O 121.074 0.364 . . . . 1.75 112.38 . . . . . . . . . 0 0 . 1 . 029 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -97.02 122.07 39.61 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.125 -0.984 . . . . 1.35 109.837 -179.552 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.401 HG21 ' H ' ' B' ' 63' ' ' LYS . 25.4 m -109.07 130.02 55.47 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.563 -0.711 . . . . 1.36 109.545 -179.783 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 67.1 mt -63.83 -29.76 70.92 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.088 -1.008 . . . . 1.24 109.567 179.821 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.401 ' H ' HG21 ' B' ' 61' ' ' THR . 30.3 mmtp -67.8 -15.87 63.84 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.418 -0.801 . . . . 1.89 109.609 -179.27 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 24.2 mm -129.96 140.49 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 O-C-N 121.765 -0.584 . . . . 1.03 110.065 -179.059 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.9 m -93.24 128.1 39.09 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.309 -1.367 . . . . 0.19 107.309 177.431 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -80.28 137.13 36.56 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.043 -1.036 . . . . 0.93 111.211 -178.287 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.557 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.6 m95 -73.59 -10.31 59.58 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.091 -1.006 . . . . 0.21 109.309 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . 0.417 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.9 m120 -54.31 -5.04 0.07 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.596 -0.69 . . . . 0.49 109.355 179.666 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.557 ' H ' ' C ' ' B' ' 67' ' ' TRP . 3.3 t -40.57 138.54 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.515 -0.741 . . . . 1.66 109.867 -179.157 . . . . . . . . 2 2 . 1 . 029 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -60.12 -37.31 79.65 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.356 -0.84 . . . . 1.36 108.959 -179.638 . . . . . . . . 1 1 . 1 . 029 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 CA-C-O 117.963 -1.465 . . . . 2.32 109.519 -179.821 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mmt . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 108.874 -0.788 . . . . 3.32 108.874 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.7 t -98.94 134.89 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.245 -0.909 . . . . 1.16 109.469 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -128.79 129.26 45.42 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.174 -1.047 . . . . 2.18 108.174 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . 0.467 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 64.4 tt0 -97.77 122.87 41.38 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.717 -0.846 . . . . 0.4 108.717 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.428 HD11 HG22 ' A' ' 5' ' ' ILE . 28.4 mm -101.3 114.49 40.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 N-CA-C 107.823 -1.177 . . . . 1.04 107.823 179.432 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.467 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 79.9 mm-40 -97.88 0.07 45.95 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.751 -1.218 . . . . 2.25 110.098 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.0 p -154.19 157.75 39.28 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.087 -1.008 . . . . 0.91 110.951 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.14 -33.91 76.49 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.313 -0.995 . . . . 2.18 108.313 178.487 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.1 m -56.37 -47.95 77.85 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.626 -0.83 . . . . 1.03 109.066 -178.776 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.34 -29.58 68.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.199 -0.938 . . . . 1.02 109.28 178.517 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.5 t80 -59.66 -46.03 90.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.93 -1.106 . . . . 0.15 109.22 -179.315 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -65.52 -42.93 91.5 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.067 -0.716 . . . . 2.07 109.067 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -64.34 -36.09 82.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.719 -0.613 . . . . 1.77 109.819 179.57 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.92 -43.29 79.54 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.407 -0.808 . . . . 1.04 109.538 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 86.9 mt -61.4 -40.0 92.78 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.176 -0.953 . . . . 1.07 108.698 179.99 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -69.28 -38.38 78.32 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.658 0.742 . . . . 1.07 109.336 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.29 -35.48 76.07 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.488 0.661 . . . . 1.07 109.909 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.2 -22.19 64.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 1.03 110.462 -178.926 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -140.99 37.07 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.006 -1.568 . . . . 0.24 109.71 179.741 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.83 5.16 49.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.379 -1.071 . . . . 1.07 110.688 -179.11 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.0 mttm -74.06 152.29 39.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.878 -1.138 . . . . 2.03 109.676 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.456 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.01 154.76 18.33 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 108.197 -1.038 . . . . 1.23 108.197 -179.37 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.456 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 58.2 t -142.56 113.41 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.987 -1.071 . . . . 1.03 109.358 -179.693 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.45 142.57 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 108.087 -1.079 . . . . 1.03 108.087 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.0 t -125.51 123.16 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.453 -0.779 . . . . 1.01 109.553 -178.992 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.517 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 35.5 t70 -98.99 119.54 37.94 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 1.05 109.953 179.588 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -96.63 25.82 4.89 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.237 -0.914 . . . . 0.73 109.577 179.433 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -59.99 145.52 45.9 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.146 -0.971 . . . . 0.84 110.23 -178.731 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.98 124.21 30.81 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.919 -1.141 . . . . 1.04 107.919 179.189 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.1 t -68.24 -29.0 67.71 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 119.29 -0.964 . . . . 1.08 108.585 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.545 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 70.3 p-90 -76.42 -13.74 60.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.023 -1.048 . . . . 0.29 109.881 179.855 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.6 t -90.27 115.64 27.64 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.26 108.596 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.405 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.94 -53.99 40.58 Favored Glycine 0 N--CA 1.489 2.23 0 C-N-CA 120.41 -0.9 . . . . 0.28 111.33 -178.798 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.405 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -50.35 -35.55 44.81 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 CA-C-N 118.768 1.284 . . . . 0.5 112.096 -179.835 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.21 -47.16 18.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 1.04 110.008 -179.545 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.93 -32.21 70.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.176 -0.953 . . . . 2.12 109.348 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.502 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.83 -29.19 68.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.551 -0.718 . . . . 2.66 110.243 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 21.4 mt -80.99 -4.41 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.655 -0.653 . . . . 1.22 111.069 -179.036 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.01 -31.76 10.16 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 120.138 -1.601 . . . . 1.44 113.211 -177.409 . . . . . . . . 3 3 . 1 . 030 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.76 -36.38 91.57 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 121.573 1.597 . . . . 0.31 112.162 -178.421 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -72.37 -51.81 18.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 118.953 -1.099 . . . . 0.45 108.498 179.588 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.81 -47.23 86.53 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.391 -0.818 . . . . 0.16 109.056 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -68.36 -43.03 78.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.557 -0.715 . . . . 0.35 110.877 179.667 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.8 m -64.03 -38.23 90.3 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.954 -1.091 . . . . 0.77 110.679 -179.306 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.92 -23.92 66.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.396 -0.815 . . . . 1.07 110.735 -178.376 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.2 m -54.26 -38.05 65.37 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.793 -1.192 . . . . 0.87 108.397 -179.426 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.63 -17.87 40.07 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.283 -0.886 . . . . 2.16 109.256 178.948 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -76.34 -36.82 58.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.749 -1.219 . . . . 2.29 108.004 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -123.53 65.69 1.01 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 106.58 -1.637 . . . . 0.95 106.58 178.108 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -62.41 -9.78 9.42 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.53 -0.915 . . . . 0.89 108.53 -179.396 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -89.37 8.9 28.31 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.787 -1.19 . . . . 1.13 107.787 178.727 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 58.4 t -127.87 145.16 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 N-CA-C 108.161 -1.052 . . . . 1.06 108.161 179.152 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.01 122.47 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.065 -1.022 . . . . 1.04 109.249 -179.12 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 33.4 m-85 -103.68 129.31 50.99 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.169 -0.957 . . . . 0.13 109.521 179.598 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.456 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.6 mp -111.94 142.37 44.43 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.126 -0.984 . . . . 1.08 109.985 179.168 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 107.016 -1.476 . . . . 1.13 107.016 177.732 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.7 t -128.86 134.38 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.477 -0.765 . . . . 1.03 110.748 -177.888 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.406 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 57.9 t0 -95.19 119.8 34.32 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.485 -0.759 . . . . 1.05 109.232 179.614 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.91 -16.68 21.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.575 -1.328 . . . . 1.04 108.306 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.545 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.1 m-20 -94.1 -44.12 8.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.439 -0.788 . . . . 1.08 111.696 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . 0.406 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 68.7 m-20 -95.81 -14.36 23.33 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.728 -1.232 . . . . 1.07 108.654 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.03 38.23 4.24 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 107.364 -1.347 . . . . 1.03 107.364 179.27 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -59.94 -23.17 63.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.758 -0.589 . . . . 1.92 110.065 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.481 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.7 p30 -65.94 -37.58 86.4 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.042 -1.036 . . . . 1.05 108.9 179.171 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.481 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.8 t -71.34 -44.1 72.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.263 -0.898 . . . . 1.1 109.548 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.09 70.57 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.442 -0.786 . . . . 1.03 111.14 -178.449 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.0 p -60.06 -32.88 71.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.084 -1.01 . . . . 0.89 109.157 -179.243 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -60.66 -38.33 84.53 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.958 -0.756 . . . . 2.06 108.958 179.176 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.02 1.4 57.22 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.438 -0.789 . . . . 1.05 110.809 -179.251 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 54.89 50.51 15.45 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.025 -1.047 . . . . 2.02 109.306 -179.328 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 133.1 30.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 118.324 -1.35 . . . . 1.05 107.959 -179.283 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -105.79 -10.99 16.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 2.16 109.917 -179.121 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.486 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.27 156.04 23.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.848 -1.157 . . . . 1.04 111.214 -179.654 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 154.36 81.04 Favored Pre-proline 0 N--CA 1.503 2.204 0 N-CA-C 108.263 -1.014 . . . . 1.04 108.263 179.059 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -76.42 141.63 70.69 Favored 'Cis proline' 0 N--CA 1.495 1.588 0 C-N-CA 123.929 -1.28 . . . . 0.19 112.799 -2.505 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -127.47 132.54 49.99 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.648 0.737 . . . . 1.04 109.39 178.832 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.517 ' CE2' ' OD1' ' A' ' 26' ' ' ASP . 88.7 m-85 -108.52 131.75 54.51 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.011 -0.737 . . . . 0.23 109.011 179.979 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.9 mt-30 -120.72 143.04 48.98 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.395 -0.965 . . . . 0.43 108.395 179.121 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -109.0 133.49 52.91 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 121.708 0.766 . . . . 0.17 110.449 -179.249 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -128.83 143.6 50.95 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 109.383 -0.599 . . . . 0.17 109.383 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . 0.405 ' CB ' ' HZ1' ' A' ' 81' ' ' LYS . 2.5 ttmp? -146.37 125.93 13.3 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.71 -1.589 . . . . 2.18 106.71 178.807 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 58.29 29.42 18.05 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.559 -0.904 . . . . 1.8 108.559 -178.466 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.531 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 77.7 11.73 85.16 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.744 -1.342 . . . . 0.23 109.744 -179.909 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.531 HE21 ' C ' ' A' ' 83' ' ' GLY . 4.5 mm-40 -111.43 132.39 54.5 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.509 -0.994 . . . . 2.75 109.989 -179.053 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -78.41 121.01 23.95 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.048 -1.093 . . . . 2.3 108.048 178.538 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -123.99 11.47 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.777 -0.577 . . . . 1.06 110.627 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -174.2 151.42 12.87 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 118.175 -1.964 . . . . 0.22 112.137 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 3.8 tp10 -163.75 140.22 6.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.923 -0.751 . . . . 1.93 109.218 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.466 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 3.9 p90 -163.87 156.86 18.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.568 -0.707 . . . . 0.16 109.246 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.71 160.25 31.34 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.596 -0.69 . . . . 0.9 110.064 -179.337 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 124.85 139.43 5.26 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.347 -1.501 . . . . 0.12 109.347 179.465 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.54 63.45 2.06 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.353 -1.086 . . . . 1.04 109.68 -179.839 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -118.76 102.25 8.68 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.732 -0.84 . . . . 1.36 108.732 178.557 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.7 -36.25 75.77 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.338 -0.851 . . . . 1.6 111.613 -179.846 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.2 -29.41 69.8 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.844 -1.16 . . . . 1.61 109.472 -179.822 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.489 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 50.5 tttp -60.98 -36.11 78.57 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.591 -0.693 . . . . 2.02 109.205 -179.242 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 45.1 mt -59.05 -39.93 83.56 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-O 122.1 0.952 . . . . 1.05 108.924 179.882 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -63.02 -41.58 99.58 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.074 -0.65 . . . . 2.1 111.077 -178.115 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.03 -43.25 79.19 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.059 -1.026 . . . . 1.06 111.526 -178.293 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -66.75 -39.94 88.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.858 -1.151 . . . . 1.04 109.892 -178.332 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.93 -48.97 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.237 -1.023 . . . . 1.04 108.237 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.7 t-20 -60.16 -35.63 75.74 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.998 0.904 . . . . 1.09 108.675 178.616 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.54 -39.79 85.02 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.994 -0.548 . . . . 2.21 109.956 -177.976 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.5 mt -99.79 -1.64 37.13 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.258 -0.901 . . . . 1.05 111.189 -179.173 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.7 p . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.401 -1.437 . . . . 1.08 109.12 -179.274 . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo . . . . . 0 N--CA 1.494 1.543 0 CA-C-O 121.141 0.392 . . . . 1.75 112.24 . . . . . . . . . 0 0 . 1 . 030 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.74 124.25 37.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.142 -0.974 . . . . 1.35 108.808 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.413 HG21 ' H ' ' B' ' 63' ' ' LYS . 21.5 m -107.2 130.12 54.77 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.22 -0.925 . . . . 1.36 109.624 -179.261 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.07 -29.13 68.02 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.838 . . . . 1.24 109.33 179.256 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.413 ' H ' HG21 ' B' ' 61' ' ' THR . 42.5 mmtm -62.18 -19.97 63.66 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.451 -0.78 . . . . 1.89 110.373 -179.055 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 26.5 mm -132.78 142.77 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.523 -0.735 . . . . 1.03 109.149 -179.814 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -103.88 125.86 50.6 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 106.803 -1.554 . . . . 0.19 106.803 177.431 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -79.33 143.85 34.77 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.849 -1.157 . . . . 0.93 111.227 -178.1 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.498 ' C ' ' H ' ' B' ' 69' ' ' VAL . 26.3 m95 -75.91 -10.56 59.52 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.229 -0.919 . . . . 0.21 108.718 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . 0.488 ' N ' HD21 ' B' ' 68' ' ' ASN . 1.5 m120 -51.57 -12.12 0.16 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.589 -0.893 . . . . 0.49 108.589 -179.914 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.498 ' H ' ' C ' ' B' ' 67' ' ' TRP . 15.5 m -65.26 142.67 16.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.357 -0.839 . . . . 1.66 108.775 179.067 . . . . . . . . 2 2 . 1 . 030 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.92 -40.0 87.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.253 -0.905 . . . . 1.36 109.331 -179.464 . . . . . . . . 1 1 . 1 . 030 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.378 -1.489 . . . . 2.32 109.378 -179.812 . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 mmt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.155 0.502 . . . . 3.32 109.781 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.8 t -98.63 140.53 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.433 -0.792 . . . . 1.16 109.534 -179.932 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -130.43 130.18 43.96 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.417 -0.802 . . . . 2.18 109.065 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -97.03 123.2 40.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.512 -0.742 . . . . 0.4 109.176 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.34 115.53 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.204 -0.935 . . . . 1.04 108.674 178.712 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -98.15 -0.42 44.33 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 2.25 109.344 179.518 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.57 155.6 35.07 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.672 -1.267 . . . . 0.91 111.944 -179.634 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.23 -33.16 74.06 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.138 -1.06 . . . . 2.18 108.138 178.389 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 80.3 m -58.12 -47.83 82.07 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.406 -0.809 . . . . 1.03 109.329 -179.473 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.74 -30.71 68.38 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.154 -0.966 . . . . 1.02 108.623 178.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 46.1 t80 -59.57 -43.77 93.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.146 -0.971 . . . . 0.15 108.849 -179.372 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -64.24 -43.31 95.32 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.123 -0.695 . . . . 2.07 109.123 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . 0.557 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -64.4 -39.34 93.66 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.505 -0.747 . . . . 1.77 110.353 179.957 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.85 -41.22 91.97 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.426 -0.796 . . . . 1.04 108.95 -179.301 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 51.6 mt -62.15 -39.99 94.46 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.911 -1.118 . . . . 1.07 108.809 179.414 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.86 -34.8 74.09 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.424 -0.797 . . . . 1.07 109.95 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.45 -36.77 76.93 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.326 -0.859 . . . . 1.07 110.212 -179.606 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.54 80.59 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.229 -0.919 . . . . 1.03 109.373 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.32 -124.58 22.59 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.656 -1.377 . . . . 0.24 109.656 -179.415 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -89.98 2.07 55.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.11 -1.229 . . . . 1.07 110.592 -178.797 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -74.61 150.22 39.74 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.829 -1.169 . . . . 2.03 109.697 -179.933 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.435 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -61.34 156.24 19.41 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.075 -1.454 . . . . 1.23 107.075 179.741 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.435 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 78.7 t -143.46 112.69 2.03 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 120.991 -1.068 . . . . 1.03 108.94 -179.532 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -103.0 138.85 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 108.498 -0.927 . . . . 1.03 108.498 179.776 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.1 t -122.08 119.66 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.488 -0.757 . . . . 1.01 109.16 -179.441 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.571 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.5 t70 -98.99 109.09 21.9 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.525 -0.735 . . . . 1.05 110.344 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -89.95 102.81 15.52 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 106.754 -1.573 . . . . 0.73 106.754 177.548 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.0 m -129.01 146.56 50.95 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.794 -0.817 . . . . 0.84 108.794 -179.743 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -85.73 122.67 30.15 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.777 -1.194 . . . . 1.04 107.777 179.104 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -65.72 -34.09 77.38 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 118.92 -1.112 . . . . 1.08 108.724 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.486 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 46.2 p-90 -70.73 -23.56 62.46 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.366 -0.833 . . . . 0.29 110.634 179.797 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -84.2 112.97 20.75 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.621 -1.251 . . . . 0.26 107.621 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.494 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.61 -49.16 81.53 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 120.415 -0.898 . . . . 0.28 111.086 -178.298 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.6 Cg_exo -53.46 -35.38 75.77 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 CA-C-N 118.616 1.208 . . . . 0.5 112.704 179.913 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.97 -55.77 5.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.228 -0.92 . . . . 1.04 109.928 -179.682 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -59.82 -37.43 79.17 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.144 -0.973 . . . . 2.12 109.421 -179.837 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.401 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 37.6 ttm -59.69 -28.95 67.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.995 . . . . 2.66 109.994 -179.618 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . 0.446 ' O ' ' CG2' ' A' ' 38' ' ' ILE . 65.2 mt -80.05 -4.5 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.725 -0.609 . . . . 1.22 110.926 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -65.39 -26.11 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 120.382 -1.449 . . . . 1.44 114.604 -177.548 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.6 Cg_exo -57.56 -37.99 95.25 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 CA-C-N 122.536 1.941 . . . . 0.31 113.148 -176.648 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -69.88 -43.31 72.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.049 -1.46 . . . . 0.45 108.478 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -63.65 -50.57 68.76 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.001 0.905 . . . . 0.16 109.788 179.208 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -68.01 -44.03 77.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 121.237 0.541 . . . . 0.35 109.691 179.701 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.1 m -60.71 -37.15 80.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.983 -1.073 . . . . 0.77 110.498 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -63.48 -22.3 66.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.705 -1.247 . . . . 1.07 110.833 -178.527 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -53.71 -37.4 63.26 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.967 -1.083 . . . . 0.87 108.279 -179.252 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 54.7 mp0 -85.65 -17.73 35.24 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.066 -1.021 . . . . 2.16 109.47 179.708 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.28 -35.71 54.87 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.754 -1.202 . . . . 2.29 107.754 179.228 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -124.94 66.57 1.11 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 106.906 -1.516 . . . . 0.95 106.906 178.025 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -64.2 -7.96 10.88 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.829 -0.804 . . . . 0.89 108.829 -179.129 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -91.09 10.16 27.97 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 108.458 -0.941 . . . . 1.13 108.458 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.7 t -128.03 149.92 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 N-CA-C 107.996 -1.113 . . . . 1.06 107.996 179.392 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.0 mm -100.72 122.19 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.791 -1.193 . . . . 1.04 109.044 -178.839 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -106.95 128.88 54.72 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.071 -1.018 . . . . 0.13 109.33 179.753 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.438 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.9 mp -114.95 142.25 46.87 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.924 -1.11 . . . . 1.08 109.5 179.183 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -111.77 130.13 55.9 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 106.753 -1.573 . . . . 1.13 106.753 177.703 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -126.39 137.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.267 -0.896 . . . . 1.03 111.741 -177.571 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 56.2 t0 -99.1 119.56 38.04 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.702 -0.851 . . . . 1.05 108.702 179.14 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -70.33 -16.95 20.4 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 O-C-N 120.946 -1.096 . . . . 1.04 108.918 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 4.3 m-20 -95.2 -39.6 10.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 1.08 111.547 -179.376 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -96.24 -17.96 20.38 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 120.832 -1.167 . . . . 1.07 108.216 179.453 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -124.92 41.2 3.57 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.477 -1.305 . . . . 1.03 107.477 179.031 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.43 -25.67 66.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.831 -0.543 . . . . 1.92 109.697 -178.747 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.529 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.1 p30 -62.97 -38.68 92.08 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.912 -1.118 . . . . 1.05 109.162 179.241 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.529 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -70.51 -44.27 77.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 121.193 -0.942 . . . . 1.1 109.868 -179.843 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.01 -37.31 69.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.364 -0.835 . . . . 1.03 111.255 -178.879 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.0 p -60.27 -33.96 73.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.793 -1.192 . . . . 0.89 109.381 -178.865 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.67 -36.57 84.28 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.576 -0.702 . . . . 2.06 109.801 179.615 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.88 -1.95 58.35 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.426 -0.797 . . . . 1.05 111.302 -178.781 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 56.94 48.8 15.14 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.033 -1.042 . . . . 2.02 109.578 -179.288 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.0 t -64.39 129.78 28.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 120.809 -1.182 . . . . 1.05 108.056 -179.828 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -103.04 -11.77 17.9 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.718 -0.613 . . . . 2.16 109.982 -179.387 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.508 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.68 154.24 17.97 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.801 -1.187 . . . . 1.04 110.377 179.767 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 74' ' ' THR . . . . . 0.4 HG21 ' HE1' ' B' ' 67' ' ' TRP . 33.0 p -130.12 155.55 80.58 Favored Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.146 -0.971 . . . . 1.04 108.767 179.039 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -73.56 144.67 81.74 Favored 'Cis proline' 0 N--CA 1.493 1.495 0 C-N-CA 123.934 -1.277 . . . . 0.19 112.999 -2.586 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.4 m -130.1 134.7 47.53 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.033 -1.099 . . . . 1.04 108.033 178.69 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.571 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -109.88 131.25 55.23 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.426 -0.796 . . . . 0.23 109.129 -179.14 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -124.3 140.43 52.97 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.289 -1.004 . . . . 0.43 108.289 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -108.29 135.85 48.91 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 121.436 0.636 . . . . 0.17 110.232 -179.32 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.02 146.53 50.32 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.669 -0.863 . . . . 0.17 108.669 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -143.4 121.64 12.25 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.759 -1.2 . . . . 2.18 107.759 -179.843 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 60.03 27.35 16.76 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.596 -0.69 . . . . 1.8 109.857 -179.427 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.24 Favored Glycine 0 N--CA 1.495 2.623 0 O-C-N 120.899 -1.126 . . . . 0.23 110.994 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -127.05 142.2 51.59 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.049 -1.265 . . . . 2.75 110.172 -179.781 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . 0.51 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 33.1 ttpt -79.6 126.75 31.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.243 -0.911 . . . . 2.3 108.977 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.5 m -119.98 11.55 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.647 -0.658 . . . . 1.06 110.683 -179.21 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 165.03 157.31 9.61 Favored Glycine 0 N--CA 1.492 2.403 0 C-N-CA 118.501 -1.809 . . . . 0.22 111.492 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.51 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 12.3 pt-20 -165.97 158.11 14.45 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.775 -0.838 . . . . 1.93 109.794 179.231 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -164.09 163.26 23.21 Favored 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 119.27 -0.972 . . . . 0.16 109.976 176.844 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.26 160.73 29.51 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 121.633 0.73 . . . . 0.9 110.175 -179.357 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 116.58 141.77 7.2 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 108.776 -1.729 . . . . 0.12 108.776 -179.873 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.1 68.5 4.15 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.315 -1.109 . . . . 1.04 111.489 -178.84 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.447 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -117.84 100.4 7.56 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 108.289 -1.004 . . . . 1.36 108.289 177.871 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.03 -33.27 73.35 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.173 -0.954 . . . . 1.6 111.619 -179.263 . . . . . . . . 3 3 . 1 . 031 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.86 -29.06 69.45 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.621 -1.3 . . . . 1.61 110.063 -179.225 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.447 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 43.3 tttp -60.93 -34.31 74.51 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.509 -0.923 . . . . 2.02 108.509 -179.086 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.3 mt -60.13 -40.05 88.43 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.714 0.768 . . . . 1.05 109.008 179.777 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.32 -41.89 98.92 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.988 -0.685 . . . . 2.1 110.836 -177.827 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.94 -43.96 70.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 1.06 111.454 -178.514 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.6 m -65.3 -39.99 93.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.088 -1.007 . . . . 1.04 109.883 -178.76 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . 0.402 ' O ' ' N ' ' A' ' 105' ' ' VAL . 63.9 mt -61.52 -48.54 88.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 108.002 -1.11 . . . . 1.04 108.002 179.235 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.9 t-20 -60.2 -36.36 77.48 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.409 -0.96 . . . . 1.09 108.409 178.727 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.59 85.75 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.637 -0.505 . . . . 2.21 109.637 -178.984 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.9 mt -99.86 -3.15 33.15 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.126 -0.984 . . . . 1.05 111.626 -179.042 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . 0.402 ' N ' ' O ' ' A' ' 101' ' ' ILE . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.397 -1.439 . . . . 1.08 109.119 -179.518 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo . . . . . 0 N--CA 1.496 1.669 0 CA-C-O 120.946 0.311 . . . . 1.75 112.361 . . . . . . . . . 0 0 . 1 . 031 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.25 126.54 34.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.199 -0.938 . . . . 1.35 109.144 179.592 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -118.58 158.23 25.83 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.298 -0.876 . . . . 1.36 109.274 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.0 mt -64.09 -19.98 65.64 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 108.983 -0.747 . . . . 1.24 108.983 178.97 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -60.78 -25.0 66.22 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.428 -0.795 . . . . 1.89 110.228 -179.433 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 26.3 mm -129.92 146.99 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 109.543 -0.539 . . . . 1.03 109.543 -179.968 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 60.9 m -104.59 126.27 51.52 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 107.176 -1.416 . . . . 0.19 107.176 177.848 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.0 m -77.46 138.18 39.09 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.672 -1.267 . . . . 0.93 111.016 -178.567 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.46 ' C ' ' H ' ' B' ' 69' ' ' VAL . 19.8 m95 -75.05 -9.63 58.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.012 -1.055 . . . . 0.21 109.556 179.056 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -52.63 -11.92 0.25 Allowed 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.335 -0.853 . . . . 0.49 109.122 -179.891 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.46 ' H ' ' C ' ' B' ' 67' ' ' TRP . 17.3 m -59.85 136.91 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.267 -0.896 . . . . 1.66 108.852 179.403 . . . . . . . . 2 2 . 1 . 031 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -60.36 -35.48 75.77 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.545 -0.722 . . . . 1.36 109.65 -179.098 . . . . . . . . 1 1 . 1 . 031 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 CA-C-O 118.001 -1.444 . . . . 2.32 109.582 179.911 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.267 0.556 . . . . 3.32 109.598 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 80.1 t -98.71 143.21 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.454 -0.779 . . . . 1.16 109.572 -179.679 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -130.58 129.85 43.3 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 108.238 -1.023 . . . . 2.18 108.238 179.94 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -98.13 124.52 42.71 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.21 -0.931 . . . . 0.4 108.96 179.566 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.2 mm -100.92 113.83 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.389 -0.819 . . . . 1.04 108.824 179.165 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -98.47 -0.38 43.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.318 -0.864 . . . . 2.25 109.395 179.077 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -154.33 155.7 35.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.971 -1.081 . . . . 0.91 111.324 179.587 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -62.66 -30.92 71.74 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.247 -1.02 . . . . 2.18 108.247 178.478 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.1 m -59.02 -48.7 80.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.35 -0.94 . . . . 1.03 108.701 -179.573 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.14 -28.8 67.62 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.85 -0.74 . . . . 1.02 109.067 179.079 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 45.0 t80 -59.89 -43.84 94.55 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.097 -1.002 . . . . 0.15 108.568 -179.683 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.89 -42.17 85.97 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.312 -0.625 . . . . 2.07 109.312 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.8 -37.14 86.6 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.43 0.633 . . . . 1.77 110.046 -179.814 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.06 80.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.289 -0.882 . . . . 1.04 108.999 -179.696 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 71.2 mt -61.02 -39.84 91.3 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.108 -0.995 . . . . 1.07 108.917 179.528 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.65 -35.27 75.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.532 -0.73 . . . . 1.07 110.2 -179.629 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.05 -37.5 75.57 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.341 -0.849 . . . . 1.07 110.801 -178.952 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.11 72.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.098 -1.002 . . . . 1.03 109.757 -179.503 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.22 20.23 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 110.24 -1.144 . . . . 0.24 110.24 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . 0.499 ' OD1' ' NZ ' ' A' ' 82' ' ' LYS . 70.7 m-20 -90.7 1.76 56.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.157 -1.201 . . . . 1.07 110.554 -178.48 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -75.73 150.12 37.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.014 -1.054 . . . . 2.03 110.251 -178.807 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.427 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.93 154.26 22.81 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 107.605 -1.257 . . . . 1.23 107.605 -179.665 . . . . . . . . 3 3 . 1 . 032 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.427 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 90.4 t -144.41 116.13 2.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.057 -1.027 . . . . 1.03 108.646 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.2 t -105.08 142.6 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 107.959 -1.126 . . . . 1.03 107.959 179.497 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -125.31 123.17 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 O-C-N 121.179 -0.951 . . . . 1.01 109.514 -179.233 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.558 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 32.8 t70 -100.64 120.07 39.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.343 -0.848 . . . . 1.05 110.427 179.303 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -97.29 25.58 5.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.335 -0.853 . . . . 0.73 110.336 179.315 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.3 m -59.47 146.62 39.63 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.923 -1.111 . . . . 0.84 110.061 -178.662 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.15 126.84 33.04 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.699 -1.223 . . . . 1.04 107.699 179.34 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 t -68.06 -34.92 77.34 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.148 -1.021 . . . . 1.08 108.365 -179.841 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.54 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 53.8 p-90 -69.86 -22.34 63.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.43 -0.794 . . . . 0.29 110.539 179.576 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.7 t -85.11 106.49 16.61 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.526 -1.287 . . . . 0.26 107.526 179.695 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.518 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.83 -46.85 92.92 Favored Glycine 0 N--CA 1.487 2.08 0 C-N-CA 120.363 -0.922 . . . . 0.28 111.084 -178.469 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -52.35 -36.21 67.82 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.942 1.371 . . . . 0.5 111.663 179.682 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.16 -49.4 13.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.493 -0.754 . . . . 1.04 109.954 179.98 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -59.9 -31.55 69.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.232 -0.918 . . . . 2.12 109.276 179.894 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.519 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -59.91 -29.79 68.6 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.252 -0.905 . . . . 2.66 109.587 -179.465 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 mt -81.55 -8.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.532 -0.73 . . . . 1.22 111.34 -179.186 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.517 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.5 ptmt -61.67 -28.38 3.95 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 120.27 -1.519 . . . . 1.44 113.621 -177.253 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.9 Cg_exo -57.63 -37.84 95.51 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 122.696 1.999 . . . . 0.31 112.178 -176.828 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -68.57 -47.72 66.07 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.601 -1.24 . . . . 0.45 108.113 179.306 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -60.34 -52.12 66.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.669 -0.644 . . . . 0.16 109.674 178.752 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -68.2 -40.28 82.2 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.478 -0.764 . . . . 0.35 110.836 -179.724 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.436 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.9 m -62.81 -39.08 93.18 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.952 -1.093 . . . . 0.77 110.666 -179.802 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.5 mt -63.18 -23.9 67.64 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.163 -0.961 . . . . 1.07 111.044 -178.383 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -53.33 -36.78 61.66 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 120.712 -1.243 . . . . 0.87 108.699 -179.18 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.2 mp0 -87.24 -14.02 42.2 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.267 -0.896 . . . . 2.16 109.179 179.395 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.29 -38.07 36.23 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.152 -1.425 . . . . 2.29 107.152 178.908 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . 0.434 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 76.3 m-85 -121.74 68.28 0.91 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 106.856 -1.535 . . . . 0.95 106.856 178.002 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.66 -9.07 12.0 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.748 -0.834 . . . . 0.89 108.748 -179.331 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.04 7.18 36.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.875 -1.157 . . . . 1.13 107.875 178.861 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.9 t -127.45 144.82 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 107.791 -1.189 . . . . 1.06 107.791 178.777 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.6 mm -100.02 121.05 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.027 -1.046 . . . . 1.04 109.419 -178.804 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 35.6 m-85 -102.06 125.54 48.77 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.16 -0.963 . . . . 0.13 109.2 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.476 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 6.7 mp -108.63 140.87 41.39 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.04 -1.038 . . . . 1.08 109.361 179.613 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -108.92 132.07 54.42 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.273 -1.751 . . . . 1.13 106.273 177.978 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 42.5 t -130.72 133.61 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.295 -0.878 . . . . 1.03 110.76 -177.659 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 57.0 t0 -96.02 119.0 33.73 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.865 -0.791 . . . . 1.05 108.865 179.681 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.25 -16.82 21.5 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 O-C-N 120.524 -1.36 . . . . 1.04 108.784 179.319 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.54 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.3 m-20 -94.78 -40.19 9.89 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.433 -0.792 . . . . 1.08 111.623 -178.467 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -98.09 -15.46 19.97 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.826 -1.171 . . . . 1.07 107.938 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.89 38.47 4.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.621 -1.251 . . . . 1.03 107.621 179.389 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -59.88 -27.74 66.96 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.731 -0.605 . . . . 1.92 109.859 -178.608 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.484 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.9 p30 -64.03 -36.0 82.55 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.686 -1.259 . . . . 1.05 109.155 179.591 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.484 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 5.7 t -71.76 -44.06 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.309 -0.869 . . . . 1.1 109.622 179.914 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.75 69.04 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.384 -0.822 . . . . 1.03 110.287 -179.187 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -60.11 -30.47 69.28 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.197 -0.94 . . . . 0.89 108.97 -179.442 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -60.54 -39.92 89.64 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.909 -0.775 . . . . 2.06 108.909 178.881 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -91.46 0.93 57.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.28 -0.887 . . . . 1.05 110.717 -179.309 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 55.76 49.97 15.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.992 -1.068 . . . . 2.02 109.134 -178.945 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -62.8 130.51 27.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 C-N-CA 118.323 -1.351 . . . . 1.05 108.363 -178.924 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -102.22 -10.63 19.41 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.656 -0.652 . . . . 2.16 109.889 -178.933 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.47 156.09 18.24 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.698 -1.251 . . . . 1.04 111.129 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -126.79 155.66 74.93 Favored Pre-proline 0 N--CA 1.497 1.903 0 N-CA-C 107.699 -1.222 . . . . 1.04 107.699 178.309 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -76.84 140.1 63.24 Favored 'Cis proline' 0 N--CA 1.492 1.411 0 C-N-CA 123.63 -1.404 . . . . 0.19 112.271 -2.275 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.0 m -125.14 132.52 53.07 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.816 -0.809 . . . . 1.04 108.816 177.799 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.558 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.4 m-85 -110.51 131.4 55.08 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.752 -0.832 . . . . 0.23 108.752 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.8 mt-30 -122.89 139.13 54.37 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.322 -0.861 . . . . 0.43 109.11 179.465 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -105.12 136.21 45.03 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.332 0.586 . . . . 0.17 110.401 -179.392 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -129.07 146.99 50.89 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 109.258 -0.645 . . . . 0.17 109.258 179.362 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -145.93 122.67 11.21 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.615 -1.254 . . . . 2.18 107.615 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . 0.499 ' NZ ' ' OD1' ' A' ' 20' ' ' ASP . 55.3 mttm 56.71 34.49 24.68 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.998 -1.064 . . . . 1.8 109.043 -177.945 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.22 20.44 79.65 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 109.894 -1.282 . . . . 0.23 109.894 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -123.96 132.13 53.67 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.369 -1.077 . . . . 2.75 110.794 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -79.02 124.01 27.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.422 -0.799 . . . . 2.3 109.021 178.923 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.82 9.27 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.656 -0.652 . . . . 1.06 110.977 -179.634 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.85 155.43 15.53 Favored Glycine 0 N--CA 1.495 2.586 0 C-N-CA 118.244 -1.931 . . . . 0.22 111.569 -179.616 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -166.78 148.73 6.28 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.818 -0.813 . . . . 1.93 109.549 179.512 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 10.4 p90 -163.91 159.5 21.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.16 109.377 178.348 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.3 p -125.79 162.31 25.4 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.044 -0.724 . . . . 0.9 109.044 -179.525 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 122.11 139.78 5.67 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.586 -1.406 . . . . 0.12 109.586 179.831 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 63.6 1.93 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.453 -1.028 . . . . 1.04 110.338 -179.64 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.2 t-20 -119.12 99.93 7.02 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.531 -0.914 . . . . 1.36 108.531 178.541 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.8 -31.43 69.33 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 1.6 111.597 -179.201 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.14 -28.87 69.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.779 -1.201 . . . . 1.61 109.763 -179.589 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . 0.428 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 77.1 tttt -61.19 -34.97 75.92 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.655 -0.868 . . . . 2.02 108.655 -179.432 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.1 mt -59.97 -39.85 87.08 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 122.124 0.964 . . . . 1.05 108.478 179.01 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . 0.434 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 36.8 tp10 -61.18 -41.46 96.83 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.853 -0.612 . . . . 2.1 111.293 -178.115 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.36 73.0 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.851 -1.156 . . . . 1.06 112.168 -178.082 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.9 m -66.56 -39.7 88.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.73 -1.232 . . . . 1.04 110.142 -178.485 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.4 mt -60.18 -50.59 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.106 -0.996 . . . . 1.04 108.699 179.897 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 65.4 t30 -61.5 -33.62 74.1 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.694 -0.854 . . . . 1.09 108.694 179.189 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -68.1 -41.38 81.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 2.21 110.69 -178.956 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 91.4 mt -97.64 -2.14 42.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -0.925 . . . . 1.05 110.951 -178.683 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.2 p . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.624 -1.298 . . . . 1.08 109.222 -179.526 . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 N--CA 1.494 1.517 0 CA-C-O 121.399 0.5 . . . . 1.75 111.865 . . . . . . . . . 0 0 . 1 . 032 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.61 123.72 37.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.347 -0.846 . . . . 1.35 109.069 179.883 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 21.2 m -104.5 129.74 52.5 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.377 -0.827 . . . . 1.36 109.637 -179.741 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.71 -29.99 70.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.235 -0.915 . . . . 1.24 109.472 179.581 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt -60.64 -17.49 47.63 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.393 -0.817 . . . . 1.89 109.256 -179.2 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 38.5 mm -128.83 140.37 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 N-CA-C 109.411 -0.589 . . . . 1.03 109.411 179.845 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.8 m -100.97 126.79 47.65 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.492 -1.299 . . . . 0.19 107.492 177.549 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.8 m -79.01 140.82 37.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.781 -1.2 . . . . 0.93 110.909 -178.512 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.49 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.1 m95 -74.27 -10.01 59.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.898 . . . . 0.21 109.578 179.499 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.7 -12.37 0.19 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.137 -0.977 . . . . 0.49 108.457 -179.869 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.49 ' H ' ' C ' ' B' ' 67' ' ' TRP . 21.2 m -64.09 146.19 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.449 -0.782 . . . . 1.66 109.198 179.425 . . . . . . . . 2 2 . 1 . 032 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -60.28 -41.0 92.39 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.13 -0.981 . . . . 1.36 109.806 -179.497 . . . . . . . . 1 1 . 1 . 032 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.381 0 CA-C-O 117.964 -1.465 . . . . 2.32 109.735 -179.842 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.2 mmm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.27 -0.641 . . . . 3.32 109.27 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.0 t -99.08 147.0 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.204 -0.935 . . . . 1.16 109.468 -179.837 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -129.94 125.52 35.66 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.81 -0.811 . . . . 2.18 108.81 -179.778 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -97.86 126.1 43.07 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.237 -1.023 . . . . 0.4 108.237 179.464 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.4 mm -100.04 112.06 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.262 -1.014 . . . . 1.04 108.262 179.795 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -96.48 -0.38 49.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.13 -0.981 . . . . 2.25 109.727 -179.655 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -153.19 155.43 36.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.967 -1.083 . . . . 0.91 110.841 179.765 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -64.25 -33.34 75.6 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 107.981 -1.118 . . . . 2.18 107.981 178.545 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 37.1 m -57.08 -48.23 79.1 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.49 -0.93 . . . . 1.03 108.49 -179.361 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.22 -29.25 68.04 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.83 . . . . 1.02 109.125 178.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 48.4 t80 -60.04 -44.64 94.52 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -0.949 . . . . 0.15 108.731 -179.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -65.38 -43.57 90.29 Favored 'General case' 0 C--N 1.297 -1.704 0 C-N-CA 119.64 -0.824 . . . . 2.07 109.031 179.631 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.8 -36.34 84.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.4 -0.813 . . . . 1.77 110.282 179.383 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -43.24 79.34 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.454 -0.779 . . . . 1.04 108.975 -179.503 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 76.2 mt -60.37 -40.22 90.07 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.027 -1.101 . . . . 1.07 108.027 179.709 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.32 -34.64 74.95 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.281 -0.887 . . . . 1.07 109.861 179.841 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.2 -36.24 79.26 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.45 -0.781 . . . . 1.07 110.472 -179.109 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.12 -30.75 71.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.215 -0.928 . . . . 1.03 109.208 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.43 -126.44 25.1 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 109.358 -1.497 . . . . 0.24 109.358 -179.618 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -91.69 3.54 54.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.32 -1.106 . . . . 1.07 110.804 -179.273 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -74.86 149.45 39.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.663 -1.273 . . . . 2.03 108.995 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.516 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.59 160.14 5.82 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 106.992 -1.484 . . . . 1.23 106.992 179.369 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.516 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 95.7 t -147.5 119.63 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 O-C-N 120.962 -1.086 . . . . 1.03 108.321 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 45.4 t -106.91 142.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 107.721 -1.214 . . . . 1.03 107.721 179.267 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.9 t -124.64 120.2 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.349 -0.844 . . . . 1.01 108.913 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . 0.567 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.4 t70 -98.61 108.71 21.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.331 -0.856 . . . . 1.05 111.628 -179.319 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -90.1 101.01 13.73 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.4 -1.704 . . . . 0.73 106.4 176.602 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 28' ' ' SER . . . . . 0.435 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 55.3 m -129.94 145.59 51.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.955 -1.128 . . . . 0.84 107.955 -179.66 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.15 122.98 29.59 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.567 -1.272 . . . . 1.04 107.567 179.474 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -63.3 -29.3 70.65 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.887 -1.153 . . . . 1.08 107.887 -179.859 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.542 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 69.6 p-90 -78.97 -10.95 59.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.475 -0.766 . . . . 0.29 111.144 -179.887 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.6 t -87.63 116.29 25.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.709 -1.244 . . . . 0.26 108.53 -179.674 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.47 -52.81 50.29 Favored Glycine 0 N--CA 1.487 2.068 0 C-N-CA 120.84 -0.695 . . . . 0.28 112.002 -178.472 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.6 Cg_endo -60.33 -28.87 87.66 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 CA-C-N 119.742 1.771 . . . . 0.5 113.148 -179.685 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.89 -47.46 21.11 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.721 -1.237 . . . . 1.04 110.018 -179.735 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -59.98 -32.27 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.293 -0.879 . . . . 2.12 109.411 179.601 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 18.3 tmm? -60.11 -29.64 68.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.591 -0.693 . . . . 2.66 109.639 -179.934 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 16.9 mt -81.59 -5.79 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.791 -0.568 . . . . 1.22 111.282 -179.107 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.559 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.62 -31.04 8.52 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 119.896 -1.753 . . . . 1.44 113.427 -177.927 . . . . . . . . 3 3 . 1 . 033 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.1 Cg_exo -60.04 -40.54 60.32 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 CA-C-N 121.297 1.499 . . . . 0.31 112.821 -178.204 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -70.17 -47.91 59.56 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.746 -1.222 . . . . 0.45 108.673 179.798 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.58 -50.66 72.64 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.302 -0.874 . . . . 0.16 109.004 179.481 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -67.85 -40.24 83.7 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.699 -0.625 . . . . 0.35 111.276 179.187 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.45 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.3 m -63.58 -39.31 94.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.647 -1.283 . . . . 0.77 110.635 -179.342 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.3 mt -60.13 -27.15 66.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.396 -0.815 . . . . 1.07 110.909 -178.571 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.5 m -50.09 -37.5 34.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.975 -1.078 . . . . 0.87 108.986 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.2 mp0 -87.59 -16.75 33.66 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.205 -0.935 . . . . 2.16 108.942 179.698 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -77.73 -35.99 51.32 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.316 -1.365 . . . . 2.29 107.316 179.462 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -124.28 69.21 1.07 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.261 -1.385 . . . . 0.95 107.261 177.953 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.0 p -65.66 -8.97 23.39 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.729 -0.841 . . . . 0.89 108.729 -179.511 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -91.13 10.15 28.12 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.72 146.42 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.706 -1.22 . . . . 1.06 107.706 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.93 121.43 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.818 -1.176 . . . . 1.04 109.78 -178.949 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 45.6 m-85 -102.78 124.2 47.87 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.255 -0.903 . . . . 0.13 109.999 179.916 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.476 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 4.2 mp -110.18 142.7 41.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.266 -0.896 . . . . 1.08 109.017 178.872 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -113.02 130.32 56.18 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 106.738 -1.578 . . . . 1.13 106.738 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.77 134.18 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.051 -1.031 . . . . 1.03 111.171 -177.777 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . 0.479 ' O ' ' N ' ' A' ' 62' ' ' ALA . 53.5 t0 -98.97 119.44 37.75 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.499 -0.926 . . . . 1.05 108.499 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.6 m -69.09 -17.7 22.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 O-C-N 120.734 -1.229 . . . . 1.04 108.889 179.349 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.0 m-20 -92.64 -39.95 11.02 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.44 -0.788 . . . . 1.08 110.939 -179.079 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -98.5 -12.25 21.47 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.864 -1.148 . . . . 1.07 107.935 178.976 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . 0.479 ' N ' ' O ' ' A' ' 58' ' ' ASP . . . -127.58 39.33 3.9 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.285 -1.376 . . . . 1.03 107.285 179.3 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -59.78 -27.74 66.81 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 115.868 -0.606 . . . . 1.92 109.385 -178.757 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.69 -38.14 88.41 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.187 -0.946 . . . . 1.05 109.329 179.353 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.527 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 8.9 t -69.72 -44.15 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.121 -0.987 . . . . 1.1 109.364 -179.917 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.36 -39.14 71.46 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.743 -0.598 . . . . 1.03 110.592 -179.036 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -61.17 -36.35 79.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.038 -1.039 . . . . 0.89 109.844 -179.01 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -61.98 -37.19 83.88 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.09 -1.006 . . . . 2.06 109.392 179.431 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.71 -0.88 57.73 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.342 -0.849 . . . . 1.05 111.364 -178.672 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 56.3 52.2 10.49 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.203 -0.936 . . . . 2.02 109.438 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.7 t -66.48 130.94 32.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 118.371 -1.332 . . . . 1.05 108.575 -179.169 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -104.06 -11.01 17.61 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.681 -0.637 . . . . 2.16 109.522 -179.422 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.454 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.54 154.28 16.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.878 -1.139 . . . . 1.04 110.938 179.906 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.8 p -129.63 156.08 79.31 Favored Pre-proline 0 N--CA 1.499 1.988 0 N-CA-C 106.828 -1.545 . . . . 1.04 106.828 178.447 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -76.16 140.94 68.69 Favored 'Cis proline' 0 N--CA 1.49 1.292 0 C-N-CA 123.818 -1.326 . . . . 0.19 111.788 -3.04 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.454 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.9 m -128.46 135.1 49.0 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.68 -0.859 . . . . 1.04 108.68 178.784 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.567 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.3 m-85 -108.83 128.83 55.24 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.873 -0.788 . . . . 0.23 108.873 -179.43 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -121.15 140.02 52.56 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.62 -1.252 . . . . 0.43 107.62 178.773 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.6 m-85 -107.72 135.08 49.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.257 0.551 . . . . 0.17 110.241 -178.942 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -126.88 147.23 50.07 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.165 -0.68 . . . . 0.17 109.165 178.985 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -146.16 125.08 12.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 106.986 -1.487 . . . . 2.18 106.986 179.378 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 57.97 27.1 14.26 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.099 -1.074 . . . . 1.8 108.099 -178.296 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . 0.412 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 80.53 11.3 84.26 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.112 -1.195 . . . . 0.23 110.112 179.944 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . 0.412 HE21 ' C ' ' A' ' 83' ' ' GLY . 5.3 mm-40 -112.98 133.39 54.96 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.511 -0.994 . . . . 2.75 110.253 -179.26 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -81.47 120.02 24.47 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.583 -0.895 . . . . 2.3 108.583 178.858 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.6 m -121.76 13.01 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.857 -0.527 . . . . 1.06 110.517 -179.288 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.59 154.79 14.29 Favored Glycine 0 N--CA 1.496 2.687 0 C-N-CA 118.304 -1.903 . . . . 0.22 112.284 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -167.2 150.6 6.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.656 -0.908 . . . . 1.93 109.816 179.397 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -164.47 160.21 20.26 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 119.284 -0.966 . . . . 0.16 109.102 177.082 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.77 161.49 27.23 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.445 -0.784 . . . . 0.9 110.52 -179.055 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.51 138.91 5.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.574 -1.41 . . . . 0.12 109.574 179.16 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.05 67.17 1.7 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.269 -1.136 . . . . 1.04 109.765 -179.588 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.89 96.97 5.47 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.813 -0.81 . . . . 1.36 108.813 178.877 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.15 -33.43 71.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.173 -0.954 . . . . 1.6 111.72 -179.55 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -62.97 -30.2 71.4 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.693 -1.255 . . . . 1.61 108.641 -179.85 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -60.61 -36.59 78.96 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.449 0.643 . . . . 2.02 109.498 -179.844 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 39.7 mt -59.05 -37.94 78.21 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.982 0.896 . . . . 1.05 108.624 179.886 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -62.89 -42.39 99.76 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 120.128 -0.629 . . . . 2.1 110.851 -177.815 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.88 -43.47 68.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.051 -1.03 . . . . 1.06 111.655 -178.399 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -64.65 -39.95 94.58 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.701 -1.249 . . . . 1.04 110.506 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.17 -48.89 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.15 -1.055 . . . . 1.04 108.15 179.252 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 23.0 t-20 -60.69 -34.03 73.74 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.543 -0.91 . . . . 1.09 108.543 178.904 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -68.01 -39.29 83.21 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.669 -0.645 . . . . 2.21 110.282 -178.883 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 92.5 mt -100.37 -3.72 30.56 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.407 -0.808 . . . . 1.05 110.978 -178.706 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 5.4 p . . . . . 0 N--CA 1.495 1.803 0 O-C-N 120.552 -1.343 . . . . 1.08 108.658 -179.762 . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 N--CA 1.495 1.576 0 CA-C-O 121.282 0.451 . . . . 1.75 112.023 . . . . . . . . . 0 0 . 1 . 033 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.44 119.64 33.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.303 -0.873 . . . . 1.35 108.967 179.484 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.4 ' O ' ' O ' ' B' ' 64' ' ' ILE . 24.1 m -109.69 129.51 55.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.363 -0.835 . . . . 1.36 109.21 179.979 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.8 mt -67.18 -29.58 69.3 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 1.24 109.762 -179.923 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt -62.61 -18.12 61.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.338 -0.851 . . . . 1.89 108.873 -179.704 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . 0.4 ' O ' ' O ' ' B' ' 61' ' ' THR . 36.1 mm -127.97 140.69 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 N-CA-C 109.199 -0.667 . . . . 1.03 109.199 -179.954 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.5 m -97.56 122.39 40.58 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 107.165 -1.42 . . . . 0.19 107.165 177.558 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.2 m -77.79 140.3 39.42 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.85 -1.156 . . . . 0.93 111.851 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.481 ' C ' ' H ' ' B' ' 69' ' ' VAL . 26.3 m95 -74.7 -11.98 60.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -0.9 . . . . 0.21 109.685 179.236 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -50.39 -13.16 0.11 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.134 -0.979 . . . . 0.49 108.546 179.826 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.481 ' H ' ' C ' ' B' ' 67' ' ' TRP . 15.3 m -61.66 144.24 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.293 -0.879 . . . . 1.66 108.887 179.049 . . . . . . . . 2 2 . 1 . 033 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -59.97 -41.3 91.64 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.018 -1.051 . . . . 1.36 109.756 -179.204 . . . . . . . . 1 1 . 1 . 033 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 117.903 -1.498 . . . . 2.32 109.666 179.556 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.2 ttm . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.274 -0.639 . . . . 3.32 109.274 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -98.31 153.54 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.329 -0.857 . . . . 1.16 109.35 -179.766 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -129.96 129.78 44.22 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.372 -0.973 . . . . 2.18 108.372 -179.798 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -96.63 122.79 39.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.239 -0.913 . . . . 0.4 108.856 -179.876 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.7 mm -100.62 111.55 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 1.04 108.678 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.2 mp0 -96.55 0.5 50.18 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.15 -0.969 . . . . 2.25 109.884 -179.421 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.1 p -154.13 156.12 36.63 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.026 -1.046 . . . . 0.91 111.04 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -64.74 -33.29 75.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.438 -0.949 . . . . 2.18 108.438 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 51.6 m -57.38 -46.31 83.55 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.48 -0.933 . . . . 1.03 108.48 -179.136 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 -31.85 70.37 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.903 -0.777 . . . . 1.02 108.903 178.689 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 51.4 t80 -58.52 -43.73 89.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.304 -0.873 . . . . 0.15 109.046 -179.527 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -66.21 -42.76 88.29 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.529 -0.868 . . . . 2.07 108.891 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -63.63 -39.51 94.53 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.644 -0.66 . . . . 1.77 110.82 179.752 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.96 82.59 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.154 -0.966 . . . . 1.04 109.24 -179.659 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 79.7 mt -61.09 -40.15 92.63 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.087 -1.079 . . . . 1.07 108.087 179.218 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.04 -37.13 78.41 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.769 -0.582 . . . . 1.07 110.513 179.72 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.09 -36.03 79.13 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.146 -0.971 . . . . 1.07 110.27 -178.924 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.7 72.55 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.078 -1.014 . . . . 1.03 109.09 179.827 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.66 -124.02 23.45 Favored Glycine 0 N--CA 1.484 1.9 0 N-CA-C 109.417 -1.473 . . . . 0.24 109.417 -179.853 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -92.14 3.89 54.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.242 -1.152 . . . . 1.07 110.983 -179.301 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -75.8 148.71 38.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.751 -1.218 . . . . 2.03 109.118 -179.914 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.482 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.7 158.56 12.45 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 107.137 -1.431 . . . . 1.23 107.137 179.759 . . . . . . . . 3 3 . 1 . 034 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.482 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 44.1 t -146.24 119.2 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 120.651 -1.281 . . . . 1.03 108.732 179.654 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.5 t -106.52 140.99 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.664 -1.236 . . . . 1.03 107.664 179.045 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.6 t -123.54 121.95 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.439 -0.788 . . . . 1.01 109.483 -179.075 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -100.14 120.26 39.6 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.493 -0.754 . . . . 1.05 109.919 179.883 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 23.31 7.16 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.257 -0.902 . . . . 0.73 110.137 179.507 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.0 m -57.43 146.26 30.08 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.032 -1.043 . . . . 0.84 110.639 -178.731 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.47 124.76 31.71 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 107.709 -1.219 . . . . 1.04 107.709 178.991 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -67.9 -33.59 75.0 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 118.657 -1.217 . . . . 1.08 108.453 -179.627 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 52.5 p-90 -70.04 -24.16 63.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.289 -0.882 . . . . 0.29 110.944 179.488 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.2 t -83.44 119.75 25.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.86 -1.15 . . . . 0.26 107.994 -179.456 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.449 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.58 -52.15 52.94 Favored Glycine 0 N--CA 1.49 2.241 0 C-N-CA 120.397 -0.906 . . . . 0.28 110.883 -178.383 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.9 Cg_exo -52.06 -37.39 68.35 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 CA-C-N 118.571 1.185 . . . . 0.5 112.635 179.59 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.38 -51.45 10.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.304 -0.873 . . . . 1.04 109.831 -179.808 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -60.07 -35.44 75.16 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.216 -0.928 . . . . 2.12 109.706 179.678 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.499 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.39 -27.74 66.27 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.502 -0.749 . . . . 2.66 109.789 -179.726 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 59.9 mt -87.86 -0.84 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.644 -0.66 . . . . 1.22 111.157 -178.786 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.583 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 1.5 ptmt -64.84 -31.36 5.4 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.299 -1.501 . . . . 1.44 112.904 -178.69 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.6 Cg_exo -56.42 -39.4 91.55 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 CA-C-N 121.026 1.402 . . . . 0.31 113.277 -177.767 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -67.99 -47.23 69.12 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.279 -1.369 . . . . 0.45 108.292 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -60.14 -53.0 62.95 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.778 0.799 . . . . 0.16 110.155 178.805 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -68.63 -40.3 80.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.72 -0.613 . . . . 0.35 111.188 -179.42 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.446 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.1 m -62.62 -40.02 95.67 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.958 -1.089 . . . . 0.77 110.769 -179.45 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -63.12 -20.87 65.77 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.307 -0.871 . . . . 1.07 110.371 -178.493 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -52.08 -39.82 60.27 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 120.759 -1.213 . . . . 0.87 108.718 -178.982 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -82.74 -17.83 42.9 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.231 -0.918 . . . . 2.16 109.596 179.246 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -76.81 -35.99 57.23 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.675 -1.266 . . . . 2.29 107.816 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -123.37 67.98 1.0 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 106.564 -1.643 . . . . 0.95 106.564 177.445 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -10.44 15.33 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.934 -0.765 . . . . 0.89 108.934 -179.265 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -89.83 8.25 32.95 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.869 -0.789 . . . . 1.13 108.869 179.481 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.7 t -126.64 147.26 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 107.539 -1.282 . . . . 1.06 107.539 178.617 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . 0.408 HG22 HD11 ' A' ' 53' ' ' ILE . 27.1 mm -100.27 123.45 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.015 -1.053 . . . . 1.04 109.342 -178.658 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 59.3 m-85 -106.09 123.96 48.83 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.136 -0.977 . . . . 0.13 109.689 179.569 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.445 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 5.6 mp -110.0 140.16 44.31 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.077 -1.014 . . . . 1.08 109.652 178.936 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -109.93 131.45 55.05 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 106.942 -1.503 . . . . 1.13 106.942 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.79 135.25 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.428 -0.795 . . . . 1.03 110.576 -177.992 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 53.8 t0 -97.49 119.71 36.53 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.19 -1.041 . . . . 1.05 108.19 179.186 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -68.38 -18.47 23.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.635 -1.291 . . . . 1.04 108.672 179.693 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.3 -40.76 10.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.384 -0.823 . . . . 1.08 111.505 -178.764 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.28 -13.69 23.18 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.717 -1.24 . . . . 1.07 108.106 179.516 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -125.59 37.83 4.29 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.426 -1.324 . . . . 1.03 107.426 179.164 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -59.7 -23.67 63.32 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.812 -0.81 . . . . 1.92 108.812 -178.757 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.2 p30 -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.979 -1.076 . . . . 1.05 108.757 178.811 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . 0.469 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 4.5 t -71.18 -46.88 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 CA-C-O 121.619 0.723 . . . . 1.1 109.88 179.873 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.48 -37.14 68.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.668 -0.645 . . . . 1.03 110.597 -178.643 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -60.09 -37.43 79.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.154 -0.967 . . . . 0.89 109.466 -179.293 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.28 -33.92 76.83 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.401 -0.812 . . . . 2.06 109.099 179.163 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.92 0.45 53.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.504 -0.747 . . . . 1.05 110.402 -179.34 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.7 mp0 53.14 50.05 18.63 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 2.02 110.379 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.4 t -67.99 134.41 30.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 O-C-N 120.59 -1.319 . . . . 1.05 108.74 -179.897 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -105.21 -12.94 15.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.548 -0.72 . . . . 2.16 109.844 -179.609 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.511 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.96 158.22 19.42 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.925 -1.11 . . . . 1.04 110.584 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 36.9 p -129.94 155.29 80.82 Favored Pre-proline 0 N--CA 1.502 2.169 0 N-CA-C 108.494 -0.928 . . . . 1.04 108.494 179.248 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -75.14 140.15 65.57 Favored 'Cis proline' 0 N--CA 1.497 1.734 0 C-N-CA 123.871 -1.304 . . . . 0.19 113.157 -2.112 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 90.0 m -125.39 130.34 51.69 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.263 -1.014 . . . . 1.04 108.263 178.163 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 91.9 m-85 -109.16 131.16 55.33 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 108.669 -0.863 . . . . 0.23 108.669 -179.529 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.0 mt-30 -123.0 141.91 51.43 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.347 -0.845 . . . . 0.43 108.743 179.764 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.8 m-85 -108.1 135.12 49.99 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.558 0.694 . . . . 0.17 110.741 -179.001 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -129.87 143.57 50.87 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.125 -0.695 . . . . 0.17 109.125 179.253 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -147.19 130.98 17.0 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 107.167 -1.42 . . . . 2.18 107.167 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 70.5 mttt 58.83 26.1 14.39 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.697 -0.853 . . . . 1.8 108.697 -178.403 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.15 22.13 71.83 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.949 -1.26 . . . . 0.23 109.949 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -129.71 141.52 50.88 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.356 -1.085 . . . . 2.75 110.406 -179.845 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -79.39 125.47 29.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.271 -0.893 . . . . 2.3 109.466 179.664 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 m -123.66 11.24 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.763 -0.586 . . . . 1.06 110.296 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.51 157.98 20.87 Favored Glycine 0 N--CA 1.497 2.701 0 C-N-CA 118.602 -1.761 . . . . 0.22 111.523 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . 0.472 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.1 tp10 -167.23 148.64 5.75 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.775 -0.838 . . . . 1.93 109.146 179.578 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.472 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.5 p90 -169.28 156.93 7.23 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.504 -0.748 . . . . 0.16 109.936 178.108 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.3 p -126.48 163.63 22.92 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.484 -0.76 . . . . 0.9 109.646 -179.588 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 119.85 142.48 6.69 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.324 -1.511 . . . . 0.12 109.324 179.836 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.68 65.67 3.22 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.316 -1.108 . . . . 1.04 110.1 -179.542 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.04 96.03 5.06 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.367 -0.975 . . . . 1.36 108.367 178.653 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -32.34 72.25 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 1.6 111.373 -179.287 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.36 -30.05 70.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.829 -1.17 . . . . 1.61 109.765 -179.566 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.42 -34.19 73.59 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.07 -0.715 . . . . 2.02 109.07 -179.035 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.91 -39.38 85.2 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.158 0.98 . . . . 1.05 108.571 179.226 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -60.68 -44.02 97.0 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 120.174 -0.61 . . . . 2.1 110.826 -178.324 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.62 -44.02 71.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 1.06 111.603 -178.203 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.0 m -64.0 -39.92 95.19 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 120.853 -1.154 . . . . 1.04 109.683 -178.864 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.84 -49.48 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 N-CA-C 108.077 -1.083 . . . . 1.04 108.077 178.876 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 19.2 t-20 -60.18 -35.23 74.9 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.257 -1.016 . . . . 1.09 108.257 179.166 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -68.0 -40.07 83.09 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.436 -0.79 . . . . 2.21 110.616 -179.188 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 90.4 mt -98.78 -3.44 35.61 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.232 -0.917 . . . . 1.05 111.185 -178.533 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 8.5 p . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.589 -1.319 . . . . 1.08 109.105 -179.758 . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo . . . . . 0 N--CA 1.495 1.616 0 CA-C-O 120.983 0.326 . . . . 1.75 112.383 . . . . . . . . . 0 0 . 1 . 034 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.05 129.85 34.8 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.074 -1.016 . . . . 1.35 108.705 179.268 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 24.1 m -98.07 120.12 37.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.955 . . . . 1.36 109.833 -179.376 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.1 mt -71.87 -24.16 61.63 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.415 -0.803 . . . . 1.24 109.863 179.36 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.6 -17.71 64.97 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.314 -0.866 . . . . 1.89 109.692 -178.532 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 29.8 mm -130.02 142.01 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.677 -0.639 . . . . 1.03 109.856 -179.208 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.5 m -101.27 129.28 47.21 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.538 -1.282 . . . . 0.19 107.538 177.961 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 58.5 m -78.72 140.61 38.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.851 -1.156 . . . . 0.93 110.644 -178.897 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.448 ' C ' ' N ' ' B' ' 69' ' ' VAL . 18.5 m95 -76.15 -10.11 59.16 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.801 -1.187 . . . . 0.21 109.566 178.972 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.85 -13.7 0.3 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.184 -0.947 . . . . 0.49 108.558 -179.683 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.448 ' N ' ' C ' ' B' ' 67' ' ' TRP . 14.0 m -60.49 145.97 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.744 -0.835 . . . . 1.66 108.744 179.093 . . . . . . . . 2 2 . 1 . 034 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -60.04 -37.73 80.65 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.042 -1.036 . . . . 1.36 109.532 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.311 -1.516 . . . . 2.32 109.311 -179.594 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.0 mmt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.359 0.6 . . . . 3.32 109.693 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.1 t -120.21 155.54 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.229 0 N-CA-C 109.206 -0.665 . . . . 1.16 109.206 179.935 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -130.06 128.87 42.82 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.524 -0.917 . . . . 2.18 108.524 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -97.66 124.33 41.92 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.177 -0.952 . . . . 0.4 108.699 179.679 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -103.27 113.81 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 N-CA-C 108.787 -0.82 . . . . 1.04 108.787 179.426 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.3 mp0 -96.09 -1.05 49.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.993 . . . . 2.25 110.092 -179.463 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -155.49 156.66 35.63 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.885 -1.135 . . . . 0.91 111.376 -179.816 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 8' ' ' LYS . . . . . 0.492 ' HZ3' ' CD ' ' A' ' 68' ' ' GLU . 14.5 ttmm -64.08 -31.96 73.35 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.456 -0.942 . . . . 2.18 108.456 178.658 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.0 m -56.72 -49.07 76.27 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.276 -0.97 . . . . 1.03 108.559 -179.478 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -30.72 69.01 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.48 -0.763 . . . . 1.02 109.21 178.782 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 11' ' ' PHE . . . . . . . . . . . . . 47.5 t80 -59.67 -42.53 93.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.15 108.875 -179.354 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -65.77 -42.5 90.77 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.31 -0.996 . . . . 2.07 108.31 179.533 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -64.27 -37.33 87.09 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.285 0.564 . . . . 1.77 110.173 179.497 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.95 77.75 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.266 -0.896 . . . . 1.04 108.986 -179.477 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 15' ' ' LEU . . . . . . . . . . . . . 54.6 mt -60.72 -40.79 93.66 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.516 -0.873 . . . . 1.07 108.668 179.908 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -68.66 -38.1 80.15 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 1.07 110.238 179.573 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.81 -37.31 84.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.347 -0.845 . . . . 1.07 110.201 -178.694 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.83 73.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.026 -1.046 . . . . 1.03 109.385 179.893 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -124.48 22.48 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.897 -1.281 . . . . 0.24 109.897 -179.6 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.24 4.48 52.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.398 -1.06 . . . . 1.07 110.149 -179.206 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -75.79 147.74 38.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.973 -1.079 . . . . 2.03 108.848 -179.673 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.52 ' CD2' ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.51 159.56 6.3 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 107.387 -1.338 . . . . 1.23 107.387 -179.392 . . . . . . . . 3 3 . 1 . 035 nuclear orig full ' A' A ' 23' ' ' VAL . . . . . 0.52 ' H ' ' CD2' ' A' ' 22' ' ' LEU . 67.1 t -148.48 118.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 120.964 -1.085 . . . . 1.03 108.097 179.578 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 t -106.48 142.73 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.912 -1.144 . . . . 1.03 107.912 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.0 t -125.92 122.46 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.414 -0.804 . . . . 1.01 109.82 -178.76 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -99.09 118.85 36.77 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.303 -0.873 . . . . 1.05 109.456 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -94.79 20.49 8.66 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.155 -0.966 . . . . 0.73 109.285 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -55.94 147.87 18.56 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 120.974 -1.079 . . . . 0.84 110.276 -178.623 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -84.51 126.03 32.93 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.398 -1.334 . . . . 1.04 107.398 178.61 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -69.07 -32.02 71.17 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.661 -1.215 . . . . 1.08 107.829 179.395 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 31' ' ' TRP . . . . . 0.499 ' CD1' ' OD2' ' A' ' 60' ' ' ASP . 62.8 p-90 -70.42 -22.42 62.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.69 -0.631 . . . . 0.29 110.98 179.81 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.2 t -84.74 115.33 22.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.788 -1.195 . . . . 0.26 108.239 -179.772 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 33' ' ' GLY . . . . . 0.445 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.29 -51.89 55.16 Favored Glycine 0 N--CA 1.488 2.15 0 C-N-CA 120.437 -0.887 . . . . 0.28 111.391 -178.397 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.2 Cg_exo -51.81 -35.45 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 CA-C-N 118.809 1.305 . . . . 0.5 111.325 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.98 -50.29 13.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.531 -0.731 . . . . 1.04 110.09 -179.747 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -59.81 -34.95 73.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.086 -1.009 . . . . 2.12 109.026 -179.765 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 37' ' ' MET . . . . . 0.54 ' O ' ' SD ' ' A' ' 37' ' ' MET . 10.1 tmm? -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.403 -0.81 . . . . 2.66 109.313 179.917 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 74.9 mt -84.95 -1.99 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.588 -0.695 . . . . 1.22 111.603 -178.938 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 39' ' ' LYS . . . . . 0.574 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 18.2 pttt -65.44 -30.11 3.82 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 120.168 -1.582 . . . . 1.44 113.26 -178.627 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 40' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.2 Cg_exo -55.08 -40.06 87.76 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 121.403 1.537 . . . . 0.31 112.533 -177.067 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.26 -45.04 74.24 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 118.367 -1.333 . . . . 0.45 108.35 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.13 -51.63 67.08 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.21 -0.931 . . . . 0.16 109.697 179.36 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -67.33 -41.84 84.59 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.524 0.678 . . . . 0.35 110.741 179.841 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.3 m -62.22 -39.94 94.44 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.273 -0.892 . . . . 0.77 110.195 -179.287 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.74 -23.14 64.72 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.344 -0.848 . . . . 1.07 110.613 -179.023 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.2 m -53.36 -35.38 60.2 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.801 -1.187 . . . . 0.87 108.849 -179.254 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . 0.534 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.3 mp0 -88.88 -13.38 39.31 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.195 -0.941 . . . . 2.16 108.959 179.198 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -77.77 -39.97 42.37 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.814 -1.18 . . . . 2.29 107.814 178.698 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -123.87 69.6 1.06 Allowed 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.741 -1.577 . . . . 0.95 106.741 178.058 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.35 -9.07 10.41 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.543 -0.91 . . . . 0.89 108.543 -179.32 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -89.68 8.03 33.66 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.202 -1.036 . . . . 1.13 108.202 179.146 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 56.0 t -126.45 142.74 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 N-CA-C 107.996 -1.113 . . . . 1.06 107.996 179.114 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 30.7 mm -97.88 121.31 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.217 -0.927 . . . . 1.04 109.65 -178.995 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 54' ' ' PHE . . . . . . . . . . . . . 43.6 m-85 -101.63 125.4 48.28 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.391 -0.818 . . . . 0.13 109.385 179.551 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.427 ' N ' ' CD1' ' A' ' 55' ' ' LEU . 5.9 mp -110.28 144.85 38.37 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.075 -1.016 . . . . 1.08 110.097 179.14 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -112.52 131.51 55.56 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.216 -1.402 . . . . 1.13 107.216 177.825 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -128.21 132.08 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.404 -0.81 . . . . 1.03 109.744 -178.849 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -95.11 120.0 34.57 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.872 -0.788 . . . . 1.05 108.872 179.873 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -64.99 -19.84 26.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.813 0 O-C-N 120.378 -1.451 . . . . 1.04 107.876 179.199 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 60' ' ' ASP . . . . . 0.499 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 28.5 m-20 -92.64 -41.67 10.06 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.457 -0.777 . . . . 1.08 112.403 -178.746 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -95.67 -18.23 20.67 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.36 -1.463 . . . . 1.07 108.99 -179.576 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.82 40.7 3.66 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.735 -1.209 . . . . 1.03 107.735 179.029 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -60.18 -19.13 52.63 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.469 -0.567 . . . . 1.92 109.469 -179.161 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 64' ' ' ASP . . . . . . . . . . . . . 1.5 p30 -62.22 -39.43 92.76 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.985 -1.072 . . . . 1.05 108.849 179.87 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 21.2 t -73.69 -43.98 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 O-C-N 121.274 -0.891 . . . . 1.1 109.849 -179.973 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.37 -40.57 81.39 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.396 -0.815 . . . . 1.03 110.471 -178.273 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.6 p -60.32 -39.29 86.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.048 -1.032 . . . . 0.89 109.177 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 68' ' ' GLU . . . . . 0.492 ' CD ' ' HZ3' ' A' ' 8' ' ' LYS . 40.4 tt0 -62.97 -38.99 93.34 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.337 -0.852 . . . . 2.06 109.832 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.68 -2.5 58.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.437 -0.789 . . . . 1.05 111.179 -178.416 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 56.03 49.15 16.26 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.163 -0.96 . . . . 2.02 109.947 -179.913 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.84 132.47 28.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 118.586 -1.246 . . . . 1.05 108.038 -179.617 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -105.26 -12.17 16.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.478 -0.764 . . . . 2.16 110.173 -179.039 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 73' ' ' ALA . . . . . 0.465 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.86 156.22 17.44 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.829 -1.169 . . . . 1.04 111.071 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -127.72 156.28 75.89 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 107.966 -1.124 . . . . 1.04 107.966 179.087 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -74.36 143.39 77.68 Favored 'Cis proline' 0 N--CA 1.494 1.547 0 C-N-CA 123.85 -1.312 . . . . 0.19 112.851 -3.682 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 76' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -128.24 133.7 48.87 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.492 -0.929 . . . . 1.04 108.492 177.926 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -111.46 131.69 55.03 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 108.803 -0.814 . . . . 0.23 108.803 -179.236 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -122.96 140.61 52.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.43 109.161 179.457 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -108.28 135.55 49.42 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.309 0.576 . . . . 0.17 110.448 -179.207 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -126.32 149.16 49.35 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.43 0.633 . . . . 0.17 109.434 179.341 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -146.76 126.41 13.37 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 106.964 -1.495 . . . . 2.18 106.964 -179.734 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.9 mttp 54.02 34.08 18.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.938 -1.101 . . . . 1.8 108.677 -177.987 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.64 20.71 79.72 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 110.017 -1.233 . . . . 0.23 110.017 179.568 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -124.45 133.5 53.35 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.427 -1.043 . . . . 2.75 110.611 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -78.4 124.06 27.69 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.241 -0.912 . . . . 2.3 109.732 179.657 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.4 m -123.99 10.8 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.663 -0.648 . . . . 1.06 110.522 -179.578 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.83 151.26 10.6 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 118.564 -1.779 . . . . 0.22 111.451 -179.819 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -164.92 148.01 8.48 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.815 -0.815 . . . . 1.93 109.045 179.285 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 89' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 11.1 p90 -164.19 159.03 19.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.198 -0.939 . . . . 0.16 110.025 178.16 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.24 159.98 31.56 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.58 0.705 . . . . 0.9 109.786 -179.529 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 91' ' ' GLY . . . . . . . . . . . . . . . 123.37 143.0 6.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.241 -1.544 . . . . 0.12 109.241 179.099 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.39 66.58 2.47 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.258 -1.142 . . . . 1.04 109.606 -179.879 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.84 92.51 3.8 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 108.175 -1.046 . . . . 1.36 108.175 178.909 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.97 -32.53 73.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.445 -0.784 . . . . 1.6 111.196 -179.093 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -63.92 -30.8 71.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.035 -1.041 . . . . 1.61 109.521 -179.619 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.36 -35.33 75.44 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 109.215 -0.661 . . . . 2.02 109.215 -179.003 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.86 -38.88 83.38 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.562 -0.903 . . . . 1.05 108.562 179.106 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.47 -43.75 98.31 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 120.261 -0.576 . . . . 2.1 110.673 -178.029 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.88 -43.81 71.07 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.211 -0.931 . . . . 1.06 111.543 -178.768 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -64.17 -39.93 95.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.868 -1.145 . . . . 1.04 110.18 -178.585 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.3 mt -61.39 -48.97 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 108.162 -1.051 . . . . 1.04 108.162 179.118 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 22.1 t-20 -60.63 -34.62 74.55 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.389 -0.967 . . . . 1.09 108.389 179.448 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -68.03 -39.93 83.02 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.532 -0.73 . . . . 2.21 110.909 -178.587 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 88.0 mt -100.17 0.22 40.09 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.108 -0.995 . . . . 1.05 111.141 -178.333 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.683 -1.26 . . . . 1.08 109.464 -179.489 . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo . . . . . 0 N--CA 1.495 1.574 0 CA-C-O 121.055 0.356 . . . . 1.75 111.865 . . . . . . . . . 0 0 . 1 . 035 nuclear orig full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.45 121.95 30.55 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 1.35 108.498 179.658 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 61' ' ' THR . . . . . 0.419 HG21 ' H ' ' B' ' 63' ' ' LYS . 22.7 m -107.44 125.88 51.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.461 -0.774 . . . . 1.36 109.844 -179.082 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.01 -23.6 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.447 -0.783 . . . . 1.24 109.788 179.702 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 63' ' ' LYS . . . . . 0.419 ' H ' HG21 ' B' ' 61' ' ' THR . 65.8 mmtt -60.79 -16.43 40.5 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.497 -0.752 . . . . 1.89 109.132 -178.914 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 64' ' ' ILE . . . . . . . . . . . . . 28.9 mm -135.85 142.43 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 N-CA-C 109.406 -0.59 . . . . 1.03 109.406 -179.649 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 9.4 m -101.71 127.2 48.58 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 107.543 -1.28 . . . . 0.19 107.543 177.634 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.1 m -78.81 139.94 38.29 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.865 -1.147 . . . . 0.93 111.562 -178.291 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 67' ' ' TRP . . . . . 0.54 ' C ' ' H ' ' B' ' 69' ' ' VAL . 24.0 m95 -72.94 -8.75 57.08 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.912 -0.773 . . . . 0.21 108.912 178.283 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -49.94 -10.59 0.05 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.794 -0.817 . . . . 0.49 108.794 179.37 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 69' ' ' VAL . . . . . 0.54 ' H ' ' C ' ' B' ' 67' ' ' TRP . 4.7 t -42.4 153.22 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.431 -0.793 . . . . 1.66 110.135 -179.446 . . . . . . . . 2 2 . 1 . 035 nuclear orig full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -60.25 -39.61 87.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 1.36 109.086 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear orig full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 CA-C-O 118.042 -1.421 . . . . 2.32 109.825 -179.855 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.497 1.922 0 N-CA-C 109.296 -0.631 . . . . 1.67 109.296 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -94.64 123.22 37.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.31 108.748 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.9 mm -99.87 116.47 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.896 -1.15 . . . . 0.19 107.896 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.516 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 55.1 mp0 -99.48 -1.08 39.36 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.34 -0.85 . . . . 2.25 109.274 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -155.74 156.49 34.94 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.988 -1.07 . . . . 0.15 111.481 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -63.34 -31.45 72.61 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.332 -0.988 . . . . 1.65 108.332 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 87.1 m -59.51 -47.52 85.22 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.729 -0.841 . . . . 0.23 108.729 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -30.5 69.8 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.381 -0.825 . . . . 0.17 108.909 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.477 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.5 t80 -59.81 -41.42 91.21 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.378 -0.826 . . . . 0.14 109.276 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -66.78 -41.88 86.97 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.769 -0.826 . . . . 1.31 108.769 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.27 -40.45 93.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.825 -0.547 . . . . 1.77 110.686 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.27 87.38 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.244 -0.91 . . . . 0.15 109.278 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.477 HD11 ' CE2' ' A' ' 11' ' ' PHE . 70.8 mt -61.71 -39.95 93.33 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.868 -1.145 . . . . 0.17 108.574 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.99 -35.32 74.32 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.641 -0.662 . . . . 1.07 109.945 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.1 -36.48 79.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.24 -0.912 . . . . 0.18 109.901 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.4 -33.06 74.72 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 0.17 109.455 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.92 -127.28 24.82 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 109.583 -1.407 . . . . 0.2 109.583 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.446 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 69.2 m-20 -90.02 2.17 55.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.258 . . . . 1.07 110.456 -178.805 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -75.22 150.09 38.72 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.906 -1.121 . . . . 1.5 110.171 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.658 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.6 155.21 15.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 107.395 -1.335 . . . . 0.47 107.395 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.656 ' H ' HD23 ' A' ' 22' ' ' LEU . 89.5 t -142.38 110.43 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.187 -0.946 . . . . 0.17 108.954 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.1 t -97.37 142.58 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 N-CA-C 108.28 -1.007 . . . . 0.14 108.28 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.1 t -124.48 124.61 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.191 -0.943 . . . . 0.13 109.49 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.531 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -101.97 118.17 36.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.488 -0.757 . . . . 1.05 109.963 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -95.8 21.63 8.28 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.288 -0.882 . . . . 0.73 109.531 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -57.5 148.59 23.3 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.926 -1.109 . . . . 0.3 110.697 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.668 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.04 123.93 32.66 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.054 -1.091 . . . . 0.22 108.054 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.6 t -67.94 -31.38 71.1 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.783 -1.167 . . . . 0.3 108.303 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.668 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.9 p-90 -71.05 -24.27 62.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.578 -0.701 . . . . 0.26 110.645 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -85.18 119.31 25.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.942 -1.098 . . . . 0.26 108.101 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.438 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.31 -53.22 47.37 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 111.134 -0.786 . . . . 0.23 111.134 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.6 Cg_exo -53.05 -37.16 78.68 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 CA-C-N 118.515 1.158 . . . . 0.31 112.344 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.6 6.63 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.487 -0.758 . . . . 0.24 110.083 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.84 -36.74 77.46 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.01 -1.056 . . . . 1.59 109.813 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.513 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.11 -29.73 67.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -0.798 . . . . 2.1 110.244 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.62 HG22 ' O ' ' A' ' 38' ' ' ILE . 52.3 mt -83.89 0.45 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.439 -0.788 . . . . 0.49 110.999 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.566 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 12.9 ptmt -68.03 -28.52 1.89 Allowed Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 120.57 -1.331 . . . . 0.8 113.406 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.566 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.3 Cg_exo -53.03 -39.61 79.06 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 CA-C-N 121.857 1.699 . . . . 0.28 112.92 -176.8 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -69.13 -45.17 70.78 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 118.438 -1.305 . . . . 0.37 108.735 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -60.21 -52.97 63.05 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.132 -0.98 . . . . 0.16 109.694 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -68.71 -44.25 74.28 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.623 -0.673 . . . . 0.32 110.726 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 54.4 m -60.64 -39.7 89.26 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.059 -1.026 . . . . 0.22 111.186 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -64.53 -19.65 65.73 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.963 -1.086 . . . . 0.22 110.945 -177.716 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -49.87 -39.84 40.68 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.902 -1.124 . . . . 0.16 108.66 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -84.53 -13.82 50.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.69 -1.257 . . . . 2.16 109.485 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -76.44 -36.29 58.04 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.613 -1.254 . . . . 1.78 107.613 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -125.85 68.88 1.18 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.023 -1.473 . . . . 0.25 107.023 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -64.28 -7.95 11.16 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.509 -0.745 . . . . 0.22 109.113 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -91.48 8.99 33.74 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.898 -1.149 . . . . 1.13 107.898 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 38.8 t -128.0 141.82 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 107.875 -1.157 . . . . 0.24 107.875 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -99.62 121.55 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.189 -0.945 . . . . 0.15 109.708 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.513 ' C ' HD12 ' A' ' 55' ' ' LEU . 40.7 m-85 -101.19 127.51 47.72 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.272 -0.893 . . . . 0.12 109.869 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -109.89 141.03 43.18 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.306 -0.871 . . . . 0.22 108.812 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -109.51 131.24 55.25 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 106.677 -1.601 . . . . 1.13 106.677 177.731 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -128.67 131.99 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.438 -0.789 . . . . 0.15 110.638 -177.976 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.615 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 40.2 t0 -96.01 120.12 35.73 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.828 -0.804 . . . . 1.05 108.828 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.5 m -67.89 -19.03 24.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 O-C-N 120.456 -1.402 . . . . 0.16 108.513 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.492 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 12.0 m-20 -92.58 -44.22 8.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.377 -0.827 . . . . 1.08 111.529 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.429 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 69.4 m-20 -94.23 -15.16 24.81 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.757 -1.214 . . . . 1.07 108.259 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.88 4.09 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.023 -1.102 . . . . 0.14 108.023 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -60.09 -26.54 66.28 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.59 -0.694 . . . . 1.47 110.35 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.513 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -64.1 -37.91 89.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.785 -1.197 . . . . 1.05 108.952 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.513 HG23 ' OD1' ' A' ' 64' ' ' ASP . 4.4 t -70.31 -44.24 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 121.275 -0.891 . . . . 0.35 109.249 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.8 -40.31 76.03 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.763 -0.586 . . . . 0.26 110.341 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.7 p -61.14 -33.59 73.64 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.199 -0.938 . . . . 0.24 109.222 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -60.36 -39.58 87.69 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.254 -0.904 . . . . 2.06 108.791 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.82 -1.49 58.0 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.349 -0.844 . . . . 0.23 110.913 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 55.68 49.92 15.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.183 -0.948 . . . . 2.02 109.605 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.7 t -61.52 128.9 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 120.663 -1.273 . . . . 0.16 109.021 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -101.34 -10.91 19.85 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.712 -0.618 . . . . 1.6 110.045 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.474 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.61 155.99 17.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.689 -1.257 . . . . 0.14 110.459 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 33.9 p -129.22 154.05 80.51 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.075 -1.083 . . . . 0.15 108.075 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -75.53 141.65 71.79 Favored 'Cis proline' 0 N--CA 1.495 1.595 0 C-N-CA 123.862 -1.307 . . . . 0.16 113.148 -1.932 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.75 131.61 47.87 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.544 -0.91 . . . . 0.13 108.544 178.118 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.531 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.6 m-85 -108.82 130.65 55.4 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 109.001 -0.74 . . . . 0.2 109.001 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.428 HE21 ' HE3' ' A' ' 85' ' ' LYS . 28.5 mt-30 -122.81 140.48 52.88 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.247 -0.908 . . . . 0.29 108.601 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.404 ' CE1' HG21 ' A' ' 100' ' ' THR . 74.2 m-85 -107.78 136.03 48.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.762 -0.586 . . . . 0.14 110.228 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -127.1 149.22 50.04 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.023 -0.732 . . . . 0.15 109.023 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -145.77 120.48 9.85 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.772 -1.196 . . . . 1.68 107.772 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.446 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 52.8 mttm 59.38 30.73 20.48 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.629 -1.248 . . . . 1.22 107.629 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.21 15.79 81.17 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.654 -1.378 . . . . 0.23 109.654 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -114.53 131.64 56.59 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.461 -1.023 . . . . 2.07 110.574 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.428 ' HE3' HE21 ' A' ' 78' ' ' GLN . 85.8 tttt -77.93 120.13 22.36 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.211 -0.93 . . . . 1.82 108.913 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.9 m -122.85 12.45 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.512 -0.742 . . . . 0.3 111.025 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.82 151.17 9.36 Favored Glycine 0 N--CA 1.49 2.297 0 C-N-CA 118.445 -1.836 . . . . 0.17 110.992 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.5 tm-20 -164.34 149.57 10.24 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.833 -0.804 . . . . 1.93 109.207 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 13.1 p90 -164.04 160.14 21.4 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.063 -1.055 . . . . 0.14 109.338 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.24 161.72 27.08 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.49 0.662 . . . . 0.12 109.749 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.456 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.98 141.04 5.82 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.542 -1.423 . . . . 0.12 109.542 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.496 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.06 66.4 2.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.18 109.903 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -120.11 94.21 4.31 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.51 -0.744 . . . . 0.88 109.51 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -31.64 72.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.062 -1.024 . . . . 1.06 111.539 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.99 -30.37 70.91 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.612 -1.305 . . . . 1.61 109.806 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -59.92 -34.33 73.06 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.627 0.727 . . . . 1.45 109.837 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.59 -39.09 83.01 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 122.046 0.927 . . . . 0.19 108.693 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.42 -44.19 97.04 Favored 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 120.111 -0.636 . . . . 2.1 110.4 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.57 -43.29 69.74 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.22 -0.925 . . . . 0.19 111.365 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.404 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.6 m -64.56 -40.37 95.45 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.978 -1.076 . . . . 0.2 108.939 -178.717 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.6 mt -61.29 -46.08 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 106.843 -1.54 . . . . 0.16 106.843 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.5 ' O ' HG12 ' A' ' 105' ' ' VAL . 16.9 t-20 -60.48 -35.82 76.82 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.748 -0.834 . . . . 0.95 108.748 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -68.57 -39.95 80.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.547 -0.721 . . . . 2.21 110.111 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.658 ' HB2' HD11 ' A' ' 22' ' ' LEU . 80.2 mt -98.96 -0.09 42.88 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.107 -0.995 . . . . 0.25 111.624 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.619 -1.3 . . . . 1.08 109.682 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.509 -0.552 . . . . 1.31 109.509 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.456 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.9 mm -128.99 141.19 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.737 -0.602 . . . . 0.15 109.844 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.4 m -100.48 128.47 46.53 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.616 -1.624 . . . . 0.19 106.616 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -82.37 143.01 31.53 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.72 -1.238 . . . . 0.2 111.724 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.428 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.1 m95 -76.25 -13.31 60.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.565 -0.709 . . . . 0.21 109.33 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 107.865 -1.161 . . . . 0.49 107.865 179.852 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.1 tttp . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 109.476 -0.564 . . . . 1.67 109.476 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -95.27 124.73 39.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.242 -0.911 . . . . 0.31 109.301 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mm -101.47 116.39 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.288 -1.004 . . . . 0.19 108.288 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -98.55 -3.54 36.16 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.009 -1.057 . . . . 2.25 109.721 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -152.26 159.93 43.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.863 -1.148 . . . . 0.15 110.975 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -63.98 -34.33 77.75 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.83 -1.174 . . . . 1.65 107.83 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -56.61 -46.22 81.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.49 -0.929 . . . . 0.23 108.49 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.56 -31.0 68.92 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.652 -0.87 . . . . 0.17 108.652 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.537 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.5 t80 -60.03 -43.3 95.4 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.105 -0.997 . . . . 0.14 108.936 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -66.56 -43.19 85.72 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.915 -0.772 . . . . 1.31 108.915 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -62.49 -40.72 97.59 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.583 -0.698 . . . . 1.77 110.622 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.11 -40.33 86.84 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.85 -1.157 . . . . 0.15 108.684 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 11' ' ' PHE . 79.8 mt -60.76 -40.86 94.03 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.17 108.203 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -70.08 -34.5 73.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.318 -0.864 . . . . 1.07 109.592 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.8 75.18 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.643 -0.661 . . . . 0.18 110.202 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.09 71.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.185 -0.947 . . . . 0.17 109.71 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.78 -127.57 25.51 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 110.455 -1.058 . . . . 0.2 110.455 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -90.79 2.42 56.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.918 -1.342 . . . . 1.07 110.307 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.5 mttt -74.05 150.69 40.47 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.005 -1.059 . . . . 1.5 110.011 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.649 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.29 156.45 15.57 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.287 -1.375 . . . . 0.47 107.287 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.649 ' H ' HD23 ' A' ' 22' ' ' LEU . 65.6 t -143.97 111.54 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.75 -1.219 . . . . 0.17 109.483 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.4 t -100.69 141.47 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 108.046 -1.094 . . . . 0.14 108.046 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.9 t -124.64 121.51 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.307 -0.871 . . . . 0.13 109.622 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -98.71 121.13 40.26 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.307 -0.871 . . . . 1.05 109.917 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.24 19.69 11.51 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.963 -1.086 . . . . 0.73 110.129 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.443 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.2 m -54.3 143.29 23.7 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.047 -1.033 . . . . 0.3 110.595 -178.486 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.506 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -81.0 129.43 34.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.031 -1.1 . . . . 0.22 108.031 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -68.62 -32.29 72.06 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.987 -1.07 . . . . 0.3 108.997 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.509 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 54.4 p-90 -73.59 -21.54 60.3 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.598 -0.841 . . . . 0.26 110.803 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.8 t -84.66 113.14 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.099 -1.001 . . . . 0.26 108.594 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.435 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.26 -51.99 55.41 Favored Glycine 0 N--CA 1.486 2.007 0 C-N-CA 120.698 -0.763 . . . . 0.23 111.334 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 33.0 Cg_exo -50.31 -36.31 46.89 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 CA-C-N 119.002 1.401 . . . . 0.31 112.056 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.443 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.88 -46.19 19.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.39 -0.818 . . . . 0.24 109.148 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -59.28 -32.9 70.46 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.08 -1.013 . . . . 1.59 109.003 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.467 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.1 tmm? -59.15 -27.75 65.94 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.635 -0.666 . . . . 2.1 110.133 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.8 mt -83.58 -5.9 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.492 -0.755 . . . . 0.49 110.952 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.545 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.15 -31.56 9.56 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 119.62 -1.925 . . . . 0.8 113.32 -176.959 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.6 Cg_exo -59.68 -40.2 66.87 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 CA-C-N 121.347 1.517 . . . . 0.28 112.129 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.77 -1.172 . . . . 0.37 109.481 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -61.15 -50.63 72.42 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.229 -0.919 . . . . 0.16 109.317 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -67.99 -41.7 81.88 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-O 121.156 0.503 . . . . 0.32 110.974 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.2 m -64.72 -37.76 88.69 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.051 -1.031 . . . . 0.22 110.392 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.54 -23.67 67.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.444 -0.785 . . . . 0.22 110.62 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.9 m -53.14 -39.88 63.83 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.724 -1.235 . . . . 0.16 108.064 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -82.9 -17.77 42.54 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.421 -0.8 . . . . 2.16 109.292 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -75.65 -37.3 59.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.95 -1.5 . . . . 1.78 106.95 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -122.03 68.48 0.93 Allowed 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.977 -1.49 . . . . 0.25 106.977 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -63.59 -11.05 21.64 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.815 -0.809 . . . . 0.22 108.815 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -89.97 8.77 30.72 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.414 -0.958 . . . . 1.13 108.414 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.41 HG13 ' HB3' ' A' ' 22' ' ' LEU . 45.6 t -127.56 146.09 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.355 -0.98 . . . . 0.24 108.355 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -99.96 122.31 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.033 -1.042 . . . . 0.15 109.451 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.534 ' C ' HD12 ' A' ' 55' ' ' LEU . 46.9 m-85 -103.73 127.95 51.15 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.272 -0.892 . . . . 0.12 109.164 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 54' ' ' PHE . 3.8 mp -111.35 139.95 46.34 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.249 -0.907 . . . . 0.22 109.153 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -111.87 129.89 56.01 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 106.828 -1.545 . . . . 1.13 106.828 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.1 t -127.25 139.12 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.608 -0.682 . . . . 0.15 110.851 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.8 t0 -99.22 118.38 35.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.598 -0.89 . . . . 1.05 108.598 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.05 -18.41 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 120.257 -1.527 . . . . 0.16 108.608 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.509 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.8 m-20 -92.27 -43.11 9.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.494 -0.754 . . . . 1.08 111.566 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.458 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.2 m-20 -95.66 -16.66 21.88 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.719 -1.238 . . . . 1.07 108.701 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.1 37.78 4.29 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.632 -1.247 . . . . 0.14 107.632 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -59.93 -20.48 57.66 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 1.47 110.154 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.598 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -66.97 -36.77 82.94 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.969 -1.082 . . . . 1.05 108.464 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.598 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.9 t -72.45 -45.65 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.424 -0.798 . . . . 0.35 109.742 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.87 -36.65 70.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.542 -0.724 . . . . 0.26 111.328 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.1 p -60.47 -37.02 79.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.212 . . . . 0.24 109.184 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.6 -35.48 80.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.495 -0.753 . . . . 2.06 109.369 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.407 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -87.27 -1.29 57.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.383 -0.823 . . . . 0.23 110.772 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mp0 54.87 49.87 16.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.215 -0.928 . . . . 2.02 109.846 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.51 135.88 27.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 120.915 -1.116 . . . . 0.16 108.562 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -107.41 -15.46 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.71 -0.619 . . . . 1.6 109.836 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.5 154.49 22.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.897 -1.127 . . . . 0.14 111.333 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.444 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.5 p -124.52 155.7 68.71 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 107.954 -1.128 . . . . 0.15 107.954 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -77.22 141.39 68.53 Favored 'Cis proline' 0 N--CA 1.495 1.567 0 C-N-CA 123.769 -1.346 . . . . 0.16 113.025 -2.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.2 m -125.87 130.73 51.92 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.644 -0.872 . . . . 0.13 108.644 177.804 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -108.77 131.44 54.95 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.759 -0.83 . . . . 0.2 108.759 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.407 HE22 ' HB1' ' A' ' 69' ' ' ALA . 74.9 mt-30 -122.97 143.48 49.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.35 -0.982 . . . . 0.29 108.35 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -109.71 134.11 52.37 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.334 0.588 . . . . 0.14 110.594 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -126.83 148.76 49.95 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.406 -0.59 . . . . 0.15 109.406 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -147.2 127.61 14.02 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.926 -1.138 . . . . 1.68 107.926 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 53.48 33.58 16.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.91 -1.119 . . . . 1.22 108.296 -178.724 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.49 20.17 79.65 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.201 -1.16 . . . . 0.23 110.201 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 38.9 mm-40 -124.07 134.06 53.48 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.351 -1.088 . . . . 2.07 111.088 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -77.9 126.17 30.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.418 -0.801 . . . . 1.82 109.25 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.7 m -124.12 4.35 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.637 -0.664 . . . . 0.3 111.038 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.67 160.63 25.97 Favored Glycine 0 N--CA 1.496 2.669 0 C-N-CA 118.14 -1.981 . . . . 0.17 111.581 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -168.56 148.02 4.41 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 122.088 -0.654 . . . . 1.93 109.882 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -162.06 160.1 27.06 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.277 -0.889 . . . . 0.14 109.118 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -126.1 160.82 29.11 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.486 0.66 . . . . 0.12 109.991 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.471 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.36 143.28 6.44 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.014 -1.635 . . . . 0.12 109.014 179.357 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.4 65.71 3.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.044 -1.268 . . . . 0.18 109.877 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -118.06 97.07 5.62 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.622 -0.881 . . . . 0.88 108.622 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.44 -33.53 73.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.489 -0.757 . . . . 1.06 111.384 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.86 -29.97 71.1 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 1.61 109.239 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -60.53 -36.93 79.6 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-O 121.439 0.638 . . . . 1.45 109.51 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 53.9 mt -57.82 -39.75 78.38 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 122.084 0.945 . . . . 0.19 108.499 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -60.98 -43.43 98.82 Favored 'General case' 0 C--N 1.289 -2.047 0 C-N-CA 119.904 -0.718 . . . . 2.1 110.879 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.28 -43.86 76.81 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.206 -0.934 . . . . 0.19 111.507 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.5 m -65.3 -40.3 93.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.709 -1.244 . . . . 0.2 109.706 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.95 -49.58 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 N-CA-C 108.196 -1.039 . . . . 0.16 108.196 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.468 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.3 t-20 -60.29 -36.04 76.94 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.923 0.868 . . . . 0.95 108.678 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -67.44 -39.98 85.42 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.808 -0.558 . . . . 2.21 110.091 -178.723 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 22' ' ' LEU . 87.7 mt -100.88 2.61 41.09 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.299 -0.875 . . . . 0.25 111.17 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.7 p . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.423 -1.423 . . . . 1.08 109.263 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.67 0.271 . . . . 1.31 110.407 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.471 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.5 mm -129.91 139.91 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.672 -0.643 . . . . 0.15 109.424 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.0 m -101.03 132.05 46.63 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 106.88 -1.526 . . . . 0.19 106.88 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m -83.93 140.01 32.22 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.603 -1.311 . . . . 0.2 111.219 -177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.444 ' NE1' HG23 ' A' ' 74' ' ' THR . 20.6 m95 -73.15 -8.65 56.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.223 -0.923 . . . . 0.21 109.921 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 47.2 m-20 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 120.949 -1.095 . . . . 0.49 108.917 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.6 tptt . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 108.796 -0.816 . . . . 1.67 108.796 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -98.72 124.1 43.35 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 0.31 108.884 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -102.8 115.08 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 108.666 -0.864 . . . . 0.19 108.666 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -97.79 -0.05 45.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.16 -0.962 . . . . 2.25 110.173 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.12 154.22 34.36 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.869 -1.144 . . . . 0.15 111.01 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -63.64 -32.39 73.85 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.175 -1.046 . . . . 1.65 108.175 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 47.6 m -57.24 -48.43 78.85 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.179 -1.008 . . . . 0.23 108.596 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.75 -31.01 69.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.36 -0.837 . . . . 0.17 109.163 178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.529 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.1 t80 -59.45 -44.03 93.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.159 -0.963 . . . . 0.14 109.006 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -65.56 -40.88 93.33 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.705 -0.85 . . . . 1.31 108.705 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.34 -37.12 86.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.555 -0.716 . . . . 1.77 110.327 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.76 -42.34 81.91 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.327 -0.858 . . . . 0.15 109.054 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.529 HD11 ' CE2' ' A' ' 11' ' ' PHE . 55.0 mt -60.73 -40.35 92.04 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.609 -0.885 . . . . 0.17 108.609 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -70.04 -38.5 75.85 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.632 -0.667 . . . . 1.07 110.275 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.3 -37.38 80.58 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.254 -0.904 . . . . 0.18 109.988 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.85 69.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.204 -0.935 . . . . 0.17 109.303 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.03 -127.28 30.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.931 -1.268 . . . . 0.2 109.931 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -89.92 1.34 56.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.263 -1.139 . . . . 1.07 110.689 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttt -73.34 150.0 42.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.788 -1.195 . . . . 1.5 109.493 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.674 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.48 156.29 16.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 107.472 -1.307 . . . . 0.47 107.472 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.674 ' H ' HD23 ' A' ' 22' ' ' LEU . 84.4 t -143.34 111.33 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.132 -0.98 . . . . 0.17 108.992 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.89 140.57 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.135 -1.061 . . . . 0.14 108.135 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.53 123.96 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.325 -0.859 . . . . 0.13 109.249 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.523 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 27.4 t70 -102.32 118.43 36.87 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.465 -0.772 . . . . 1.05 109.692 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -95.42 23.15 6.18 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.197 -0.939 . . . . 0.73 109.974 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.1 m -59.13 145.7 41.47 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.742 -1.224 . . . . 0.3 110.078 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.724 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.74 126.87 32.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 107.957 -1.127 . . . . 0.22 107.957 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 t -68.08 -30.14 69.25 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.263 -1.014 . . . . 0.3 108.263 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.724 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.1 p-90 -76.44 -15.03 60.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.488 -0.757 . . . . 0.26 110.624 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.16 121.05 28.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.809 -1.182 . . . . 0.26 108.378 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -64.66 -53.62 33.83 Favored Glycine 0 N--CA 1.495 2.58 0 O-C-N 121.542 -0.724 . . . . 0.23 112.698 -177.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.5 Cg_endo -61.11 -29.92 88.16 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 CA-C-N 119.349 1.575 . . . . 0.31 112.279 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.22 17.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.155 -0.966 . . . . 0.24 109.442 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -59.75 -30.84 69.13 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.067 -1.021 . . . . 1.59 109.111 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' A' ' 37' ' ' MET . 13.8 tmm? -59.69 -28.4 67.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.643 -0.661 . . . . 2.1 109.498 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.6 mt -81.48 -4.13 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 O-C-N 121.545 -0.722 . . . . 0.49 111.179 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.21 -31.95 10.49 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 119.982 -1.699 . . . . 0.8 113.528 -177.063 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.9 Cg_exo -59.09 -39.84 75.99 Favored 'Trans proline' 0 N--CA 1.494 1.529 0 CA-C-N 121.387 1.531 . . . . 0.28 113.244 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -69.12 -49.22 59.03 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.504 -1.372 . . . . 0.37 108.849 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -59.99 -51.22 70.57 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.728 -0.842 . . . . 0.16 108.728 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 46.3 t60 -66.11 -44.14 85.16 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.897 -0.502 . . . . 0.32 110.985 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.5 m -63.24 -39.98 96.13 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.828 -1.17 . . . . 0.22 110.722 -179.322 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.02 -23.9 65.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.194 -0.941 . . . . 0.22 110.596 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -52.14 -40.19 61.01 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.84 -1.163 . . . . 0.16 108.602 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -84.66 -15.33 45.75 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.316 -0.865 . . . . 2.16 109.569 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -76.97 -38.08 53.95 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 107.502 -1.296 . . . . 1.78 107.502 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -121.64 68.0 0.91 Allowed 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 106.671 -1.603 . . . . 0.25 106.671 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 p -63.22 -9.88 13.18 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.384 -0.969 . . . . 0.22 108.384 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -90.23 9.75 27.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.129 -1.063 . . . . 1.13 108.129 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.3 t -127.85 143.94 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.861 -1.163 . . . . 0.24 107.861 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.6 mm -99.95 120.58 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 120.994 -1.066 . . . . 0.15 109.483 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.575 ' C ' HD12 ' A' ' 55' ' ' LEU . 51.9 m-85 -103.3 126.06 50.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.181 -0.949 . . . . 0.12 109.816 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.575 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -110.09 144.49 38.62 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.257 -0.902 . . . . 0.22 110.045 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -112.97 131.48 55.73 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.24 -1.393 . . . . 1.13 107.24 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.5 t -129.5 132.81 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.277 -0.89 . . . . 0.15 110.409 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.469 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 51.7 t0 -94.58 120.05 34.21 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.376 -0.827 . . . . 1.05 109.308 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.6 m -66.55 -18.17 23.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.478 -1.389 . . . . 0.16 108.156 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 16.1 m-20 -93.29 -44.79 8.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.441 -0.787 . . . . 1.08 112.264 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.443 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 78.9 m-20 -94.83 -13.61 25.38 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.554 -1.341 . . . . 1.07 108.91 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.4 37.88 4.31 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.542 -1.281 . . . . 0.14 107.542 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -60.12 -20.9 60.55 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.772 -0.58 . . . . 1.47 109.496 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.655 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -62.64 -36.96 84.51 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.929 -1.107 . . . . 1.05 108.473 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.655 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.4 t -73.31 -42.11 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.299 -0.876 . . . . 0.35 109.112 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.7 -41.43 79.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.392 -0.818 . . . . 0.26 111.083 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -59.99 -37.94 81.13 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.983 -1.073 . . . . 0.24 109.666 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -66.61 -37.93 85.92 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 2.06 109.507 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.56 -3.73 58.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.159 -0.963 . . . . 0.23 110.948 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 54.05 49.88 17.87 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.984 -1.073 . . . . 2.02 110.541 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.85 131.69 30.64 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.723 -1.236 . . . . 0.16 108.999 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -102.45 -10.73 19.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.572 -0.705 . . . . 1.6 110.655 -179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.504 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.97 154.27 17.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.607 -1.308 . . . . 0.14 111.136 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.409 HG23 ' NE1' ' B' ' 67' ' ' TRP . 34.4 p -127.36 154.12 77.17 Favored Pre-proline 0 N--CA 1.502 2.147 0 N-CA-C 107.585 -1.265 . . . . 0.15 107.585 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -75.97 141.64 71.25 Favored 'Cis proline' 0 N--CA 1.497 1.718 0 C-N-CA 124.172 -1.179 . . . . 0.16 113.006 -1.981 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 91.5 m -126.98 132.29 50.84 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 121.657 0.742 . . . . 0.13 109.26 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.701 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.2 m-85 -109.0 130.24 55.47 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.779 -0.823 . . . . 0.2 108.779 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -122.16 140.35 52.67 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.615 -0.883 . . . . 0.29 108.615 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -107.9 134.86 50.22 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.398 0.618 . . . . 0.14 110.186 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -129.19 146.04 51.2 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.288 0.566 . . . . 0.15 109.56 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -145.46 134.89 23.13 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 107.283 -1.376 . . . . 1.68 107.283 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.8 mttt 50.06 33.36 6.81 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.923 -1.11 . . . . 1.22 109.014 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.98 25.68 74.22 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.58 -1.408 . . . . 0.23 109.58 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -129.14 132.78 47.4 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.465 -1.02 . . . . 2.07 110.989 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.1 122.89 26.8 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.083 -0.71 . . . . 1.82 109.083 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.0 m -123.35 8.33 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.698 . . . . 0.3 110.433 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.44 153.86 14.35 Favored Glycine 0 N--CA 1.495 2.578 0 C-N-CA 118.344 -1.884 . . . . 0.17 111.82 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -166.05 149.11 7.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 122.033 -0.686 . . . . 1.93 109.56 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.43 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 19.9 p90 -163.66 163.66 24.22 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.279 -0.968 . . . . 0.14 109.339 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.91 160.34 31.3 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.504 0.669 . . . . 0.12 110.191 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.2 141.69 5.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.594 -1.402 . . . . 0.12 109.594 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.27 65.41 2.85 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.288 -1.125 . . . . 0.18 109.347 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -118.55 93.95 4.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.587 -0.894 . . . . 0.88 108.587 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.47 74.65 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.273 -0.892 . . . . 1.06 111.494 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.84 -29.79 70.95 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.758 -1.214 . . . . 1.61 109.307 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.43 ' NZ ' ' CD2' ' A' ' 89' ' ' PHE . 56.5 tttm -61.11 -34.75 75.46 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.558 -0.714 . . . . 1.45 109.215 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.701 HD21 ' CD1' ' A' ' 77' ' ' PHE . 38.6 mt -58.92 -38.91 80.03 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.967 -1.123 . . . . 0.19 107.967 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -61.93 -42.54 99.21 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.906 -0.718 . . . . 2.1 110.966 -178.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.75 -43.8 75.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.003 -1.061 . . . . 0.19 111.717 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.4 m -65.65 -39.63 91.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.694 -1.254 . . . . 0.2 110.055 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -60.92 -49.15 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.921 -1.112 . . . . 0.16 108.73 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 105' ' ' VAL . 21.6 t-20 -60.5 -35.52 76.13 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.151 -1.055 . . . . 0.95 108.151 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -67.45 -39.94 85.39 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 115.973 -0.558 . . . . 2.21 110.143 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.6 mt -99.23 -1.46 39.12 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.172 -0.955 . . . . 0.25 111.344 -178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 102' ' ' ASN . 4.9 p . . . . . 0 N--CA 1.498 1.97 0 O-C-N 120.49 -1.381 . . . . 1.08 109.426 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.459 -0.571 . . . . 1.31 109.459 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.445 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.6 mm -129.56 140.0 50.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.843 -0.535 . . . . 0.15 109.732 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -98.06 127.33 43.94 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 106.525 -1.658 . . . . 0.19 106.525 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.0 m -80.79 145.2 31.58 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.833 -1.167 . . . . 0.2 110.755 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.504 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.0 m95 -77.39 -9.94 59.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.133 -0.979 . . . . 0.21 108.815 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 42.4 m-20 . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.355 -0.841 . . . . 0.49 108.762 179.73 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.3 tptt . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 108.345 -0.983 . . . . 1.67 108.345 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.532 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 65.4 tt0 -96.75 124.26 40.68 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.421 -0.799 . . . . 0.31 108.944 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.8 mm -102.65 117.1 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 108.505 -0.924 . . . . 0.19 108.505 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.532 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 64.4 mm-40 -99.72 -2.51 35.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.289 -0.882 . . . . 2.25 109.888 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -155.15 157.27 37.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.185 -0.947 . . . . 0.15 111.115 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.191 -1.04 . . . . 1.65 108.191 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.4 m -55.84 -48.4 75.57 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.354 -0.938 . . . . 0.23 109.191 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.72 -30.33 67.93 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.254 -0.904 . . . . 0.17 109.218 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.5 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.3 t80 -58.88 -44.26 91.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.326 -0.859 . . . . 0.14 109.38 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -64.81 -42.31 95.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.308 -0.87 . . . . 1.31 109.151 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.534 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.55 -39.58 94.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.753 -0.592 . . . . 1.77 110.451 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.99 -41.1 87.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.234 -0.917 . . . . 0.15 109.12 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.5 HD11 ' CE2' ' A' ' 11' ' ' PHE . 77.8 mt -60.58 -40.42 91.67 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 108.11 -1.07 . . . . 0.17 108.11 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -69.09 -35.99 77.09 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.353 0.597 . . . . 1.07 110.416 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.4 79.58 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.271 -0.893 . . . . 0.18 109.541 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.15 -34.6 73.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.363 -0.836 . . . . 0.17 109.799 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.21 -125.65 21.66 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 110.019 -1.232 . . . . 0.2 110.019 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -90.86 2.41 56.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.237 -1.155 . . . . 1.07 110.462 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -73.83 151.83 40.42 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.93 -1.106 . . . . 1.5 109.622 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.671 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.52 158.16 18.65 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 106.811 -1.552 . . . . 0.47 106.811 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.671 ' H ' HD23 ' A' ' 22' ' ' LEU . 57.8 t -145.62 123.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.987 -1.07 . . . . 0.17 108.743 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -112.2 140.25 32.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 108.483 -0.932 . . . . 0.14 108.483 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.7 t -123.44 119.99 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.358 -0.838 . . . . 0.13 109.499 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -97.42 119.75 36.54 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.306 -0.871 . . . . 1.05 110.038 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -96.52 25.26 5.21 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.955 -1.091 . . . . 0.73 110.175 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.524 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.4 m -59.89 147.33 38.91 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 120.954 -1.091 . . . . 0.3 110.773 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.577 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.48 126.53 32.87 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.772 -1.196 . . . . 0.22 107.772 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.5 -33.97 76.19 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.024 -1.102 . . . . 0.3 108.024 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.577 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 59.7 p-90 -71.35 -26.63 62.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.447 -0.783 . . . . 0.26 110.686 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.6 t -80.7 112.9 18.51 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.834 -1.172 . . . . 0.26 107.834 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.469 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.36 -51.22 60.09 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 111.274 -0.73 . . . . 0.23 111.274 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -49.84 -37.87 46.41 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.754 1.277 . . . . 0.31 111.318 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.524 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -75.37 -46.98 29.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.191 -0.943 . . . . 0.24 108.913 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -59.74 -30.15 68.64 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.626 -0.879 . . . . 1.59 108.626 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 12.4 tpt -59.67 -30.19 68.58 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.601 -0.687 . . . . 2.1 110.14 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.443 HD11 ' HB1' ' A' ' 92' ' ' ALA . 6.3 mt -83.58 -4.79 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.695 -0.628 . . . . 0.49 110.756 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.548 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.54 -31.94 10.21 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.803 -1.81 . . . . 0.8 113.236 -176.836 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -57.91 -38.96 90.35 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 CA-C-N 121.487 1.567 . . . . 0.28 111.914 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -71.79 -51.23 23.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.146 -0.971 . . . . 0.37 108.985 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.44 -48.04 82.01 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.16 -0.962 . . . . 0.16 108.613 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -68.62 -41.24 79.77 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.567 -0.708 . . . . 0.32 110.746 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 58.7 m -63.82 -37.21 86.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.997 -1.064 . . . . 0.22 109.952 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.1 mt -62.29 -27.82 69.29 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.108 -0.995 . . . . 0.22 110.649 -178.649 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.2 m -51.73 -38.02 53.5 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 120.873 -1.142 . . . . 0.16 109.03 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -87.02 -15.7 37.88 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.12 -0.987 . . . . 2.16 109.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -79.02 -37.94 37.82 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.625 -1.297 . . . . 1.78 107.709 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -120.32 65.93 0.83 Allowed 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 106.857 -1.534 . . . . 0.25 106.857 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.4 p -62.93 -8.11 6.51 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 108.625 -0.88 . . . . 0.22 108.625 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -91.02 4.44 52.08 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.957 -0.757 . . . . 1.13 108.957 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.503 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.0 t -124.29 147.84 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.078 -1.453 . . . . 0.24 107.078 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.17 123.5 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 120.956 -1.09 . . . . 0.15 109.248 -178.42 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.579 ' C ' HD12 ' A' ' 55' ' ' LEU . 52.4 m-85 -103.94 126.87 51.38 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.35 -0.844 . . . . 0.12 110.039 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.579 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.4 mp -111.98 141.76 45.23 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 121.281 -0.887 . . . . 0.22 109.518 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -111.82 132.27 54.79 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 107.313 -1.366 . . . . 1.13 107.313 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.88 135.68 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.268 -0.895 . . . . 0.15 110.486 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 45.3 t0 -98.48 120.61 39.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.444 -0.785 . . . . 1.05 109.121 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.21 -19.6 25.92 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 O-C-N 120.643 -1.286 . . . . 0.16 108.404 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.525 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.0 m-20 -93.05 -41.65 9.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.521 -0.737 . . . . 1.08 111.812 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -95.54 -16.66 22.01 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.645 -1.284 . . . . 1.07 108.659 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.71 39.06 4.05 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.777 -1.194 . . . . 0.14 107.777 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.11 -19.99 56.07 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.753 -0.592 . . . . 1.47 109.938 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.581 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -65.03 -36.55 84.74 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.073 -1.017 . . . . 1.05 108.877 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.581 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -72.73 -42.44 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 108.409 -0.96 . . . . 0.35 108.409 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.04 -40.66 82.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.608 -0.683 . . . . 0.26 110.568 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.6 p -60.23 -40.29 89.71 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.761 -1.175 . . . . 0.24 109.577 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -66.2 -39.38 89.61 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 2.06 109.175 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.419 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.52 -4.68 59.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.152 -0.968 . . . . 0.23 110.739 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 53.77 49.98 18.01 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.852 -1.155 . . . . 2.02 109.887 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.6 t -65.01 130.46 30.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 C-N-CA 118.425 -1.31 . . . . 0.16 108.375 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -103.05 -11.07 18.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.576 -0.702 . . . . 1.6 110.694 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.495 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.25 155.81 23.2 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.599 -1.313 . . . . 0.14 110.605 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.1 p -129.44 153.63 80.63 Favored Pre-proline 0 N--CA 1.501 2.1 0 N-CA-C 108.148 -1.056 . . . . 0.15 108.148 178.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -76.59 143.33 75.75 Favored 'Cis proline' 0 N--CA 1.489 1.259 0 C-N-CA 123.613 -1.411 . . . . 0.16 112.667 -2.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.3 m -127.85 135.0 49.44 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.23 -1.026 . . . . 0.13 108.23 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -113.32 131.84 55.8 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.966 -0.753 . . . . 0.2 108.966 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.419 HE22 ' HB1' ' A' ' 69' ' ' ALA . 69.6 mt-30 -120.44 141.86 49.76 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.283 -1.006 . . . . 0.29 108.283 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -108.03 134.8 50.42 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.472 0.653 . . . . 0.14 110.226 -179.23 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -128.64 147.11 50.71 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 109.176 -0.675 . . . . 0.15 109.176 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -149.62 125.29 10.39 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.788 -1.19 . . . . 1.68 107.788 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 59.74 30.2 19.78 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 107.787 -1.19 . . . . 1.22 107.787 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.1 14.91 81.8 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.713 -1.355 . . . . 0.23 109.713 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -116.89 135.64 53.56 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.546 -0.973 . . . . 2.07 110.91 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -78.98 123.88 27.72 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.695 -0.854 . . . . 1.82 108.695 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.2 m -123.8 7.61 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.472 -0.768 . . . . 0.3 111.439 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.95 156.13 17.22 Favored Glycine 0 N--CA 1.498 2.819 0 C-N-CA 118.426 -1.845 . . . . 0.17 111.513 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -164.71 149.17 9.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.872 -0.781 . . . . 1.93 109.353 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.447 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 7.0 p90 -163.86 159.44 21.09 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.635 -0.826 . . . . 0.14 109.78 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.6 p -127.37 160.65 30.76 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.595 0.712 . . . . 0.12 109.924 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.476 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.22 140.6 5.7 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.17 -1.572 . . . . 0.12 109.17 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.443 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.28 67.27 2.5 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.219 -1.165 . . . . 0.18 109.146 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -120.37 95.09 4.59 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.548 -0.908 . . . . 0.88 108.548 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -34.76 77.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.141 -0.975 . . . . 1.06 111.403 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.97 -28.71 70.27 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.077 -1.015 . . . . 1.61 109.412 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.84 -34.64 76.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.331 -0.856 . . . . 1.45 108.836 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.46 -38.69 81.44 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.218 -1.03 . . . . 0.19 108.218 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -63.16 -43.4 98.41 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 119.845 -0.742 . . . . 2.1 110.46 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -44.0 77.33 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 0.19 111.143 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.9 m -65.37 -39.67 92.6 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.973 -1.079 . . . . 0.2 110.706 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.01 -48.36 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.067 -1.02 . . . . 0.16 108.267 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 105' ' ' VAL . 26.0 t-20 -60.5 -34.75 74.52 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.194 -1.039 . . . . 0.95 108.194 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.9 tt0 -67.93 -39.89 83.44 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.548 -0.72 . . . . 2.21 110.63 -178.488 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.655 ' HB2' HD11 ' A' ' 22' ' ' LEU . 86.2 mt -100.68 0.28 38.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.226 -0.922 . . . . 0.25 111.273 -178.802 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.8 p . . . . . 0 N--CA 1.497 1.905 0 O-C-N 120.569 -1.332 . . . . 1.08 108.992 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 108.847 -0.797 . . . . 1.31 108.847 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.476 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.7 mm -126.34 139.97 50.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 109.372 -0.603 . . . . 0.15 109.372 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 5.0 m -96.45 127.98 42.96 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 106.54 -1.652 . . . . 0.19 106.54 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.3 m -78.89 144.25 35.09 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.852 -1.155 . . . . 0.2 110.554 -178.204 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.442 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.8 m95 -79.62 -14.62 58.68 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.21 109.056 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 25.6 m-20 . . . . . 0 N--CA 1.487 1.419 0 N-CA-C 107.788 -1.19 . . . . 0.49 107.788 179.14 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 108.782 -0.821 . . . . 1.67 108.782 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -97.01 124.03 40.88 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.867 -0.79 . . . . 0.31 108.867 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.2 mm -102.15 115.83 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 108.17 -1.048 . . . . 0.19 108.17 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -99.68 0.14 41.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.333 -0.854 . . . . 2.25 109.619 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.2 155.15 37.21 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.146 -0.971 . . . . 0.15 110.929 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.599 ' HA ' HG22 ' A' ' 65' ' ' VAL . 4.3 ttpm? -65.26 -32.85 74.72 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.765 -1.198 . . . . 1.65 107.765 177.916 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.444 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 46.5 m -58.71 -46.98 86.12 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.215 -1.031 . . . . 0.23 108.215 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.24 -31.76 70.53 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.37 -0.831 . . . . 0.17 108.837 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.559 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.2 t80 -59.81 -43.71 94.37 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.14 109.15 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -64.45 -44.01 92.47 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.584 -0.847 . . . . 1.31 108.796 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.44 -41.1 98.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.565 -0.709 . . . . 1.77 110.723 179.301 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.76 -42.17 95.34 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.252 -0.905 . . . . 0.15 109.285 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.559 HD11 ' CE2' ' A' ' 11' ' ' PHE . 87.1 mt -59.85 -39.86 86.62 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.089 -1.007 . . . . 0.17 108.418 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.41 -34.67 74.81 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.592 -0.693 . . . . 1.07 110.476 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.02 80.9 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.18 110.591 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.21 -30.97 69.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.127 -0.983 . . . . 0.17 110.067 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.95 -125.7 25.42 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.171 -1.172 . . . . 0.2 110.171 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -90.7 3.49 54.1 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -1.143 . . . . 1.07 109.964 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -75.63 148.55 38.67 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 1.5 109.892 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.698 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.54 157.78 16.51 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.667 -1.234 . . . . 0.47 107.667 179.306 . . . . . . . . 3 3 . 1 . 005 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.698 ' H ' HD23 ' A' ' 22' ' ' LEU . 46.9 t -147.01 118.07 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 120.903 -1.123 . . . . 0.17 108.884 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 139.48 27.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.378 -0.971 . . . . 0.14 108.378 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.5 t -123.02 122.62 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.135 -0.978 . . . . 0.13 110.081 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -98.21 119.7 37.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.441 -0.787 . . . . 1.05 109.919 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -96.38 24.46 5.79 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.068 -1.02 . . . . 0.73 109.886 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.436 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.7 m -58.64 146.94 34.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.3 110.077 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.678 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.55 122.92 30.37 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.926 -1.139 . . . . 0.22 107.926 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 t -67.28 -30.26 70.08 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 118.962 -1.095 . . . . 0.3 108.088 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.678 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 52.1 p-90 -71.45 -27.0 62.96 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.441 -0.787 . . . . 0.26 110.885 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.6 t -83.79 120.49 26.1 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.109 -1.071 . . . . 0.26 108.109 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -62.37 -52.1 51.69 Favored Glycine 0 N--CA 1.489 2.2 0 C-N-CA 119.846 -1.169 . . . . 0.23 111.042 -178.516 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.4 Cg_exo -52.15 -34.58 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.702 1.251 . . . . 0.31 112.59 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.436 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.96 -53.77 7.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.91 . . . . 0.24 110.276 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -60.0 -37.37 79.48 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.803 -1.185 . . . . 1.59 109.701 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.525 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.0 tmm? -58.46 -27.98 64.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.148 -0.97 . . . . 2.1 109.342 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.4 mt -87.01 -12.07 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.599 -0.688 . . . . 0.49 112.051 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 29.6 pttt -67.44 -30.53 3.03 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 120.062 -1.649 . . . . 0.8 113.511 -177.504 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.8 Cg_exo -49.79 -36.78 43.43 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 121.803 1.68 . . . . 0.28 112.215 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -67.79 -44.13 78.09 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.384 -1.71 . . . . 0.37 106.384 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.35 -52.45 65.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.946 . . . . 0.16 110.101 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -67.62 -40.11 84.68 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.49 -0.757 . . . . 0.32 109.928 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 70.3 m -61.17 -39.58 90.7 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.381 -0.824 . . . . 0.22 110.567 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.2 mt -62.36 -19.58 63.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.45 -0.781 . . . . 0.22 110.707 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -55.4 -37.12 67.18 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.593 -1.317 . . . . 0.16 108.471 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -82.73 -19.8 37.22 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.509 -0.744 . . . . 2.16 109.103 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -76.62 -37.36 56.5 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.91 -1.144 . . . . 1.78 107.91 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -123.69 67.12 1.02 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.136 -1.431 . . . . 0.25 107.136 177.879 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 80.2 p -63.44 -10.05 15.47 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.42 0.629 . . . . 0.22 109.573 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -91.02 10.43 26.69 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.215 -1.031 . . . . 1.13 108.215 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 22' ' ' LEU . 48.2 t -128.52 148.21 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 108.353 -0.98 . . . . 0.24 108.353 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.443 HG22 ' CD1' ' A' ' 55' ' ' LEU . 30.0 mm -98.79 123.95 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.129 -0.982 . . . . 0.15 109.688 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.505 ' C ' HD12 ' A' ' 55' ' ' LEU . 65.7 m-85 -108.43 123.86 49.52 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.354 -0.841 . . . . 0.12 109.246 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.505 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.9 mp -110.26 144.81 38.41 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 120.906 -1.121 . . . . 0.22 110.136 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -112.54 129.73 56.26 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 106.577 -1.638 . . . . 1.13 106.577 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.4 t -126.46 135.54 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.19 -0.944 . . . . 0.15 110.63 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.696 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.2 t0 -94.47 119.66 33.51 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.738 -0.838 . . . . 1.05 108.738 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.2 m -69.16 -18.52 22.85 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 C-N-CA 118.638 -1.225 . . . . 0.16 108.453 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.8 m-20 -93.01 -42.68 9.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.45 -0.781 . . . . 1.08 111.343 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.484 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 81.3 m-20 -93.92 -15.26 25.13 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.623 -1.298 . . . . 1.07 108.098 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.4 38.39 4.16 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 107.684 -1.228 . . . . 0.14 107.684 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.8 pt20 -59.56 -22.63 61.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 1.47 109.8 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 4.8 p-10 -66.07 -42.9 88.81 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.104 -0.997 . . . . 1.05 108.766 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.599 HG22 ' HA ' ' A' ' 8' ' ' LYS . 21.2 t -68.72 -44.01 82.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 O-C-N 121.328 -0.858 . . . . 0.35 109.88 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.81 72.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.215 -0.928 . . . . 0.26 110.324 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.8 p -61.6 -31.66 71.74 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.045 -1.034 . . . . 0.24 108.711 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -63.81 -40.16 95.97 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.445 -0.785 . . . . 2.06 109.398 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.403 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -88.69 1.39 55.19 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.461 -0.774 . . . . 0.23 110.923 -179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 54.49 50.83 15.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.991 -1.068 . . . . 2.02 109.246 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.1 t -64.35 129.16 27.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 C-N-CA 118.261 -1.376 . . . . 0.16 107.939 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -101.71 -12.71 18.16 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.65 -0.656 . . . . 1.6 109.904 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.47 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.58 156.93 21.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.98 -1.075 . . . . 0.14 110.7 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -129.38 154.62 80.71 Favored Pre-proline 0 N--CA 1.501 2.103 0 N-CA-C 108.184 -1.043 . . . . 0.15 108.184 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -75.0 142.02 73.51 Favored 'Cis proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.841 -1.316 . . . . 0.16 113.439 -1.562 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -126.31 132.19 51.68 Favored 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.521 -0.918 . . . . 0.13 108.521 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.598 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.5 m-85 -111.39 127.15 55.57 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.401 -0.962 . . . . 0.2 108.401 -178.935 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.403 HE22 ' CB ' ' A' ' 69' ' ' ALA . 76.6 mt-30 -119.5 141.48 49.15 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.149 -0.969 . . . . 0.29 108.898 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.405 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 70.8 m-85 -107.8 132.21 53.64 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.198 0.523 . . . . 0.14 110.177 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -125.63 146.3 49.77 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.553 0.692 . . . . 0.15 109.499 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -146.69 129.78 16.46 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.622 -1.251 . . . . 1.68 107.622 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 53.34 31.99 12.89 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.108 -0.995 . . . . 1.22 109.76 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.36 19.78 77.83 Favored Glycine 0 N--CA 1.491 2.321 0 O-C-N 120.954 -1.091 . . . . 0.23 110.879 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -128.77 139.79 52.03 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.311 -1.111 . . . . 2.07 110.378 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -81.3 127.83 33.16 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.196 -0.94 . . . . 1.82 109.506 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.2 m -123.94 9.74 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.608 -0.683 . . . . 0.3 110.283 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.97 151.14 9.68 Favored Glycine 0 N--CA 1.5 2.952 0 C-N-CA 118.719 -1.705 . . . . 0.17 111.713 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -166.06 148.92 7.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.621 -0.929 . . . . 1.93 109.806 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -163.72 162.93 24.25 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.598 -0.841 . . . . 0.14 108.81 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.7 p -126.74 159.92 32.34 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.351 -0.611 . . . . 0.12 109.351 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.487 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.4 143.37 6.16 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.834 -1.306 . . . . 0.12 109.834 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.42 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.58 65.12 2.34 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.15 -1.206 . . . . 0.18 110.098 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -119.46 94.0 4.27 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 107.936 -1.135 . . . . 0.88 107.936 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -33.15 73.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.079 -1.013 . . . . 1.06 111.303 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 -63.41 -30.18 71.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.943 -1.098 . . . . 1.61 109.291 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -60.73 -33.68 73.27 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.167 -0.679 . . . . 1.45 109.167 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.598 HD21 ' CD1' ' A' ' 77' ' ' PHE . 35.8 mt -59.76 -38.95 83.22 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.566 -0.902 . . . . 0.19 108.566 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -62.67 -40.93 98.62 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.095 -0.642 . . . . 2.1 110.992 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.39 -44.1 72.15 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.246 -0.909 . . . . 0.19 112.027 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.55 -38.62 91.64 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.724 -1.235 . . . . 0.2 110.025 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.13 -48.91 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 108.162 -1.051 . . . . 0.16 108.162 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.449 ' O ' HG12 ' A' ' 105' ' ' VAL . 18.1 t-20 -61.0 -34.12 74.32 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.561 -0.903 . . . . 0.95 108.561 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -68.85 -39.86 79.7 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.485 -0.759 . . . . 2.21 110.186 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.566 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.4 mt -100.72 1.45 40.45 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.376 -0.828 . . . . 0.25 111.345 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.8 p . . . . . 0 N--CA 1.499 2.002 0 O-C-N 120.475 -1.391 . . . . 1.08 109.064 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.935 0.398 . . . . 1.31 109.953 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.487 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.1 mm -131.94 140.71 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 N-CA-C 109.716 -0.476 . . . . 0.15 109.716 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 56.4 m -98.63 131.68 44.63 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.817 -1.549 . . . . 0.19 106.817 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -81.18 144.85 31.33 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.629 -1.294 . . . . 0.2 111.372 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.444 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.2 m95 -79.62 -13.86 59.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.21 109.106 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 107.363 -1.347 . . . . 0.49 107.363 179.404 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptp . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 108.77 -0.826 . . . . 1.67 108.77 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -93.84 121.92 35.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.14 -0.975 . . . . 0.31 109.316 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.3 mm -101.51 117.53 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.492 -0.929 . . . . 0.19 108.492 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -99.1 -1.75 38.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.377 -0.827 . . . . 2.25 109.515 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.26 155.33 36.38 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.825 -1.172 . . . . 0.15 111.542 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -63.61 -32.87 74.47 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.94 -1.133 . . . . 1.65 107.94 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 80.5 m -58.71 -45.89 88.57 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.153 -1.019 . . . . 0.23 108.316 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.86 -31.82 69.86 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.304 -0.873 . . . . 0.17 108.86 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.556 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.5 t80 -59.14 -43.94 92.04 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.007 . . . . 0.14 108.691 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -64.62 -42.67 95.34 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.623 -0.88 . . . . 1.31 108.623 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.08 -36.85 85.37 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.67 -0.644 . . . . 1.77 109.963 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.13 -42.81 79.63 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.071 -1.018 . . . . 0.15 109.339 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.556 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.6 mt -60.52 -39.36 87.56 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.124 -1.065 . . . . 0.17 108.124 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.61 -34.37 73.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.466 -0.771 . . . . 1.07 109.892 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.68 -37.8 70.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.21 -0.931 . . . . 0.18 110.3 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -32.44 73.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.254 -0.904 . . . . 0.17 109.309 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.63 -124.76 21.95 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.983 -1.247 . . . . 0.2 109.983 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -91.41 4.74 51.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.397 -1.061 . . . . 1.07 110.271 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -76.54 149.3 36.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.154 -0.966 . . . . 1.5 109.096 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.644 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.86 156.68 16.76 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.503 -1.295 . . . . 0.47 107.503 179.631 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.644 ' H ' HD23 ' A' ' 22' ' ' LEU . 97.8 t -143.09 113.15 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.932 -1.105 . . . . 0.17 108.676 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.1 t -100.02 139.79 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.443 -0.947 . . . . 0.14 108.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.2 t -124.03 122.09 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.416 -0.803 . . . . 0.13 110.832 -178.827 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.528 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.7 t70 -98.44 120.24 38.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.631 -0.668 . . . . 1.05 110.305 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.53 25.74 4.89 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.96 -1.088 . . . . 0.73 109.756 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.535 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 57.0 m -59.43 143.25 50.35 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 120.878 -1.139 . . . . 0.3 110.453 -178.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.14 127.96 33.66 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 106.979 -1.489 . . . . 0.22 106.979 178.727 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -67.35 -32.25 73.06 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 118.894 -1.122 . . . . 0.3 108.318 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.623 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 61.3 p-90 -73.06 -19.8 61.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.023 -1.048 . . . . 0.26 110.657 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.2 t -85.24 116.73 23.76 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.736 -1.228 . . . . 0.26 107.867 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.451 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.57 -51.78 55.4 Favored Glycine 0 N--CA 1.496 2.662 0 O-C-N 121.659 -0.65 . . . . 0.23 111.978 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.1 Cg_exo -52.83 -36.09 72.56 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 CA-C-N 118.464 1.132 . . . . 0.31 111.907 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.535 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -76.52 -52.57 9.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.516 -0.74 . . . . 0.24 110.301 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -59.94 -36.59 77.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.129 -0.982 . . . . 1.59 109.332 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.506 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.9 tmm? -59.9 -29.3 68.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.501 -0.749 . . . . 2.1 109.549 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.604 HG22 ' O ' ' A' ' 38' ' ' ILE . 78.5 mt -79.44 -2.26 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.913 -0.492 . . . . 0.49 110.488 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.39 6.25 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 120.591 -1.318 . . . . 0.8 114.049 -177.891 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -57.24 -39.8 87.37 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 CA-C-N 121.842 1.693 . . . . 0.28 113.022 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -69.56 -48.52 60.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.262 -1.524 . . . . 0.37 108.651 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.06 -51.77 68.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.351 -0.843 . . . . 0.16 109.745 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -67.35 -40.94 85.87 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.589 -0.694 . . . . 0.32 110.385 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.449 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -61.31 -38.64 87.58 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.695 -1.253 . . . . 0.22 110.737 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.72 -21.52 66.44 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.22 110.701 -178.159 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -55.67 -35.62 66.2 Favored 'General case' 0 C--N 1.296 -1.721 0 O-C-N 120.894 -1.129 . . . . 0.16 108.277 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -85.97 -19.54 30.27 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.893 . . . . 2.16 109.897 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.24 -37.65 57.38 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 107.468 -1.308 . . . . 1.78 107.468 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.15 67.58 0.99 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.078 -1.453 . . . . 0.25 107.078 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.79 -8.27 10.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.037 -0.727 . . . . 0.22 109.037 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -90.67 10.2 26.73 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.115 -1.068 . . . . 1.13 108.115 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.5 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.5 t -129.56 142.08 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 107.696 -1.224 . . . . 0.24 107.696 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.457 HG22 ' CD1' ' A' ' 55' ' ' LEU . 26.8 mm -97.92 121.87 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.092 -1.005 . . . . 0.15 109.588 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.451 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.5 m-85 -101.62 124.15 46.8 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.364 -0.835 . . . . 0.12 109.159 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 2.3 mp -109.81 146.17 35.49 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.759 -1.213 . . . . 0.22 109.382 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.8 129.21 56.51 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 106.98 -1.489 . . . . 1.13 106.98 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.0 t -124.91 132.32 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.503 0.668 . . . . 0.15 110.377 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 54.6 t0 -95.68 118.7 32.84 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.531 -0.914 . . . . 1.05 108.531 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -65.59 -18.76 24.47 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 O-C-N 120.121 -1.612 . . . . 0.16 107.862 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.504 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.45 -40.85 10.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.631 . . . . 1.08 112.23 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.428 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 46.1 m-20 -95.61 -20.89 18.6 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.249 -1.532 . . . . 1.07 108.632 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.69 41.02 3.38 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.732 -1.21 . . . . 0.14 107.732 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -60.03 -20.66 59.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.579 -0.701 . . . . 1.47 110.097 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.721 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -62.77 -38.03 89.0 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 120.874 -1.141 . . . . 1.05 109.445 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.721 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.3 t -75.18 -44.46 43.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.013 -1.054 . . . . 0.35 109.825 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.34 -39.1 78.35 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.552 -0.859 . . . . 0.26 110.206 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -60.79 -36.48 79.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.007 -1.058 . . . . 0.24 108.539 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -63.09 -39.02 93.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 2.06 109.408 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.39 -0.06 55.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.23 110.697 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 53.09 50.2 18.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.966 -1.084 . . . . 2.02 109.728 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -66.55 132.38 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.859 -1.151 . . . . 0.16 109.35 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -103.19 -8.37 20.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.578 -0.701 . . . . 1.6 110.767 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.497 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.62 156.16 17.95 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.573 -1.33 . . . . 0.14 111.191 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.43 153.76 80.64 Favored Pre-proline 0 N--CA 1.502 2.148 0 N-CA-C 107.274 -1.38 . . . . 0.15 107.274 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -75.81 143.74 77.85 Favored 'Cis proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.848 -1.313 . . . . 0.16 112.788 -2.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.45 ' CG2' ' OE2' ' A' ' 88' ' ' GLU . 98.3 m -129.13 134.31 48.0 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.808 0.813 . . . . 0.13 108.953 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.77 ' CD1' HD21 ' A' ' 97' ' ' LEU . 93.4 m-85 -110.44 129.43 55.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 109.329 -0.619 . . . . 0.2 109.329 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -122.53 141.24 51.88 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.451 -0.944 . . . . 0.29 108.451 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -108.27 132.07 54.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.673 -0.642 . . . . 0.14 110.399 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -125.41 145.67 49.95 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.337 -0.616 . . . . 0.15 109.337 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -145.92 127.47 15.1 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.305 -1.368 . . . . 1.68 107.305 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 58.35 23.19 10.23 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.121 -1.066 . . . . 1.22 108.121 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 82.02 15.88 73.74 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 110.105 -1.198 . . . . 0.23 110.105 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -116.2 138.01 51.64 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.519 -0.989 . . . . 2.07 109.891 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -81.28 121.5 26.25 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.012 -1.107 . . . . 1.82 108.012 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.2 m -121.28 13.3 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.572 -0.705 . . . . 0.3 110.254 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -180.0 156.93 19.2 Favored Glycine 0 N--CA 1.496 2.637 0 C-N-CA 118.897 -1.621 . . . . 0.17 111.071 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.471 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 2.2 tp10 -166.84 147.73 5.91 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.65 -0.912 . . . . 1.93 108.727 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.456 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 11.0 p90 -166.98 162.58 15.69 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.199 -1.0 . . . . 0.14 108.945 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -128.88 169.61 14.4 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.621 0.724 . . . . 0.12 109.821 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.474 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 113.39 141.96 8.12 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.198 -1.561 . . . . 0.12 109.198 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.547 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -80.01 66.46 5.5 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.35 -1.088 . . . . 0.18 109.779 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -119.05 100.06 7.11 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.853 -1.166 . . . . 0.88 107.853 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.99 -33.37 73.57 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.352 -0.842 . . . . 1.06 111.924 -178.751 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -64.6 -29.49 70.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.802 -1.186 . . . . 1.61 110.051 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.413 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 55.2 tttp -61.9 -34.87 76.84 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.699 -0.852 . . . . 1.45 108.699 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.77 HD21 ' CD1' ' A' ' 77' ' ' PHE . 43.4 mt -59.48 -40.02 85.63 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 122.279 1.038 . . . . 0.19 108.484 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -62.61 -42.51 99.62 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.545 -0.752 . . . . 2.1 110.981 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.75 77.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.101 -0.999 . . . . 0.19 111.288 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -64.76 -39.59 93.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.773 -1.205 . . . . 0.2 110.129 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' VAL . 65.4 mt -61.55 -49.41 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.16 108.509 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.472 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.6 t-20 -60.26 -35.55 75.77 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.046 0.927 . . . . 0.95 108.613 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -67.32 -40.13 85.92 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.66 -0.65 . . . . 2.21 109.654 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.599 ' HB2' HD11 ' A' ' 22' ' ' LEU . 95.2 mt -98.74 -3.94 34.61 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.545 -0.722 . . . . 0.25 111.458 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.0 p . . . . . 0 N--CA 1.497 1.897 0 O-C-N 120.392 -1.443 . . . . 1.08 108.807 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp . . . . . 0 N--CA 1.492 1.638 0 N-CA-C 109.711 -0.477 . . . . 1.31 109.711 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.474 HD11 ' HA2' ' A' ' 91' ' ' GLY . 30.4 mm -128.8 140.42 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.914 -0.491 . . . . 0.15 110.304 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -95.66 129.76 42.76 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.224 -1.399 . . . . 0.19 107.224 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.6 m -78.52 140.58 38.54 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.757 -1.214 . . . . 0.2 111.049 -178.886 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.497 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.0 m95 -76.12 -8.44 57.01 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.699 -1.25 . . . . 0.21 108.975 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 . . . . . 0 C--N 1.3 -1.564 0 O-C-N 121.124 -0.985 . . . . 0.49 108.739 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.2 tptt . . . . . 0 N--CA 1.499 1.989 0 N-CA-C 108.848 -0.797 . . . . 1.67 108.848 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -97.79 124.11 42.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.383 -0.823 . . . . 0.31 109.288 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.28 115.85 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.349 -0.845 . . . . 0.19 108.788 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -99.67 -0.89 39.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.265 -0.897 . . . . 2.25 108.978 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -151.68 153.88 35.25 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.046 . . . . 0.15 111.04 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -64.3 -31.55 72.8 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.254 -1.017 . . . . 1.65 108.254 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.5 m -58.15 -47.21 84.07 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.382 -0.927 . . . . 0.23 108.601 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.12 -30.9 70.15 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.515 -0.74 . . . . 0.17 109.107 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.49 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.8 t80 -59.35 -44.05 92.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.252 -0.905 . . . . 0.14 108.977 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -65.41 -41.85 93.17 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.404 -0.961 . . . . 1.31 108.404 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.37 -37.49 87.7 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.664 -0.648 . . . . 1.77 110.299 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.12 79.14 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.277 -0.89 . . . . 0.15 109.586 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.49 HD11 ' CE2' ' A' ' 11' ' ' PHE . 88.3 mt -60.15 -40.63 90.52 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.166 -0.959 . . . . 0.17 108.537 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -68.48 -37.08 79.82 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.654 -0.653 . . . . 1.07 110.243 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.06 -36.65 80.21 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.44 -0.787 . . . . 0.18 110.406 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.31 -33.11 74.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.041 -1.037 . . . . 0.17 109.294 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.19 20.18 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.268 -1.133 . . . . 0.2 110.268 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.462 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 71.0 m-20 -89.92 0.53 57.02 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.263 -1.139 . . . . 1.07 110.457 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -73.98 147.59 42.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.825 -1.172 . . . . 1.5 109.401 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.692 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.21 159.73 7.25 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.118 -1.438 . . . . 0.47 107.118 179.79 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.685 ' H ' HD23 ' A' ' 22' ' ' LEU . 96.0 t -146.41 121.27 2.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 O-C-N 120.812 -1.18 . . . . 0.17 108.605 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.4 HG22 ' CE2' ' A' ' 79' ' ' PHE . 23.6 t -109.59 140.0 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.305 -0.998 . . . . 0.14 108.305 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.59 121.27 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.329 -0.857 . . . . 0.13 109.557 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.2 t70 -98.41 117.61 33.21 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.457 -0.777 . . . . 1.05 109.756 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -94.48 25.72 3.78 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.142 -0.974 . . . . 0.73 110.02 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.414 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 53.2 m -59.31 146.62 38.92 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 121.102 -0.999 . . . . 0.3 110.616 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.531 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.42 126.82 32.64 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.785 -1.191 . . . . 0.22 107.785 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.13 -31.61 71.31 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.938 -1.105 . . . . 0.3 108.909 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.531 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 56.1 p-90 -74.1 -22.4 59.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.427 -0.795 . . . . 0.26 111.04 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -83.39 110.44 18.15 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.74 -1.207 . . . . 0.26 107.74 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.474 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.86 -50.35 68.49 Favored Glycine 0 N--CA 1.485 1.907 0 C-N-CA 120.258 -0.972 . . . . 0.23 110.772 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.5 Cg_exo -52.48 -34.86 63.79 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 CA-C-N 118.88 1.34 . . . . 0.31 111.804 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.01 -50.73 11.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.24 110.247 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -60.19 -35.27 75.02 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.05 -1.031 . . . . 1.59 109.37 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.3 ttt -58.68 -27.32 64.71 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.391 -0.818 . . . . 2.1 109.571 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.571 HG22 ' O ' ' A' ' 38' ' ' ILE . 70.0 mt -85.02 -3.77 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.694 -0.629 . . . . 0.49 110.882 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.547 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.5 ptmt -66.94 -27.05 1.6 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 120.278 -1.514 . . . . 0.8 113.315 -177.929 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.9 Cg_exo -56.38 -39.33 91.98 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 CA-C-N 122.349 1.875 . . . . 0.28 112.117 -177.592 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -68.17 -46.06 71.77 Favored 'General case' 0 C--N 1.301 -1.506 0 C-N-CA 118.181 -1.408 . . . . 0.37 108.458 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -60.11 -52.1 66.79 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.914 0.864 . . . . 0.16 109.406 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -67.27 -45.57 76.24 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.7 -0.625 . . . . 0.32 110.244 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.3 m -60.2 -38.4 83.2 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.263 -0.898 . . . . 0.22 110.601 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 mt -63.08 -24.48 67.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.086 -1.009 . . . . 0.22 110.753 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.4 m -53.4 -36.24 61.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.872 -1.142 . . . . 0.16 108.745 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 mp0 -85.3 -15.98 41.57 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.035 -1.041 . . . . 2.16 108.627 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.0 -37.61 38.77 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.393 -1.336 . . . . 1.78 107.393 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -123.69 69.05 1.03 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.338 -1.356 . . . . 0.25 107.338 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -65.66 -13.45 59.21 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 108.35 -0.981 . . . . 0.22 108.35 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -82.23 -3.74 55.69 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.321 -0.992 . . . . 1.13 108.321 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.476 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.0 t -118.43 141.75 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 N-CA-C 107.463 -1.31 . . . . 0.24 107.463 178.752 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -97.96 122.38 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.172 -0.955 . . . . 0.15 109.822 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.657 ' C ' HD12 ' A' ' 55' ' ' LEU . 39.1 m-85 -101.06 131.51 46.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.311 -0.868 . . . . 0.12 110.419 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.657 HD12 ' C ' ' A' ' 54' ' ' PHE . 6.4 mp -116.33 140.96 48.78 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.288 -0.883 . . . . 0.22 109.243 178.49 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -110.21 130.01 55.62 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.843 -1.54 . . . . 1.13 106.843 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.99 135.11 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.253 -0.904 . . . . 0.15 110.663 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.507 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 54.3 t0 -97.03 119.76 36.12 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.76 -0.83 . . . . 1.05 108.76 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 28.1 m -68.85 -17.63 22.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.786 -1.197 . . . . 0.16 108.213 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.529 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.5 m-20 -94.24 -41.02 9.69 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.403 -0.81 . . . . 1.08 112.041 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.451 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 41.0 m-20 -96.86 -16.56 20.69 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.598 -1.314 . . . . 1.07 108.293 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.09 39.89 3.86 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.03 -1.1 . . . . 0.14 108.03 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -60.08 -24.56 64.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.676 -0.64 . . . . 1.47 110.224 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.545 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.4 p30 -63.71 -37.33 86.94 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.812 -1.18 . . . . 1.05 108.739 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.545 HG23 ' OD1' ' A' ' 64' ' ' ASP . 8.1 t -70.34 -44.04 77.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.271 -0.893 . . . . 0.35 109.587 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.52 67.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.516 -0.74 . . . . 0.26 111.178 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -60.26 -35.72 76.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.948 -1.095 . . . . 0.24 109.541 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -63.65 -36.9 85.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.292 -0.88 . . . . 2.06 109.181 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.417 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -88.44 -2.21 58.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.23 -0.919 . . . . 0.23 110.884 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 55.44 49.04 17.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.04 -1.038 . . . . 2.02 109.847 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.4 t -64.05 133.02 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 C-N-CA 118.574 -1.25 . . . . 0.16 108.442 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -104.86 -12.36 16.29 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.639 -0.663 . . . . 1.6 109.936 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.55 155.99 20.34 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.849 -1.157 . . . . 0.14 111.207 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.405 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.5 p -129.31 155.51 79.89 Favored Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 107.859 -1.163 . . . . 0.15 107.859 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -76.05 141.77 71.56 Favored 'Cis proline' 0 N--CA 1.493 1.469 0 C-N-CA 123.749 -1.355 . . . . 0.16 112.675 -1.957 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -127.38 137.3 52.72 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.597 -0.89 . . . . 0.13 108.597 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.789 ' CD1' HD21 ' A' ' 97' ' ' LEU . 90.9 m-85 -113.74 130.04 56.49 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 108.612 -0.884 . . . . 0.2 108.612 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.454 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 80.9 mt-30 -120.57 140.02 52.11 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.269 -0.894 . . . . 0.29 108.673 179.341 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.436 ' CE1' HG21 ' A' ' 100' ' ' THR . 86.5 m-85 -107.48 133.01 52.6 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.436 0.636 . . . . 0.14 110.318 -179.168 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -128.61 145.92 51.0 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 108.996 -0.742 . . . . 0.15 108.996 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -147.81 131.24 16.66 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.16 -1.422 . . . . 1.68 107.16 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.462 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 68.6 mttm 56.01 27.93 12.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.279 -0.888 . . . . 1.22 109.549 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.86 15.29 79.5 Favored Glycine 0 N--CA 1.493 2.485 0 C-N-CA 120.061 -1.066 . . . . 0.23 110.902 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -125.06 141.54 52.06 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.088 -1.243 . . . . 2.07 110.508 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.454 ' NZ ' ' OE1' ' A' ' 78' ' ' GLN . 20.3 ttmm -78.56 126.98 31.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.274 -0.892 . . . . 1.82 109.392 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.89 11.75 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.728 -0.608 . . . . 0.3 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.93 154.14 14.52 Favored Glycine 0 N--CA 1.494 2.552 0 C-N-CA 118.388 -1.863 . . . . 0.17 111.743 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 3.2 tp10 -165.14 136.49 4.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.997 -0.708 . . . . 1.93 109.642 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.543 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.9 p90 -163.26 158.5 21.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.328 -0.857 . . . . 0.14 109.947 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -127.97 160.18 32.7 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.61 0.719 . . . . 0.12 110.37 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 126.56 141.88 5.55 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.394 -1.482 . . . . 0.12 109.394 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.451 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.2 65.17 2.12 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.339 -1.095 . . . . 0.18 109.626 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -120.0 97.78 5.77 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.353 -0.842 . . . . 0.88 108.77 179.042 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -33.28 73.31 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.017 -1.052 . . . . 1.06 111.174 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.18 -30.08 70.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.953 -1.092 . . . . 1.61 109.68 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.54 -34.72 74.55 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.566 -0.709 . . . . 1.45 109.337 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.789 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.4 mt -59.44 -40.07 85.59 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.551 -0.907 . . . . 0.19 108.551 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.95 -43.92 97.48 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 119.402 -0.919 . . . . 2.1 110.347 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.62 -44.81 77.1 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.136 -1.026 . . . . 0.19 110.624 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.436 HG21 ' CE1' ' A' ' 79' ' ' PHE . 22.0 m -64.3 -40.06 95.18 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.793 -1.192 . . . . 0.2 108.478 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.95 -46.64 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 107.503 -1.295 . . . . 0.16 107.503 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.473 ' O ' HG12 ' A' ' 105' ' ' VAL . 49.4 t30 -60.12 -35.94 76.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.05 -1.093 . . . . 0.95 108.05 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -68.73 -40.1 80.05 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.626 -0.671 . . . . 2.21 110.164 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.692 ' HB2' HD11 ' A' ' 22' ' ' LEU . 87.6 mt -98.26 -2.73 38.9 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.143 -0.973 . . . . 0.25 111.63 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.2 p . . . . . 0 N--CA 1.499 1.999 0 O-C-N 120.504 -1.372 . . . . 1.08 109.551 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.706 -0.479 . . . . 1.31 109.706 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.445 HD11 ' HA2' ' A' ' 91' ' ' GLY . 36.3 mm -130.04 141.44 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.812 -0.555 . . . . 0.15 109.754 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 24.2 m -99.9 131.51 45.83 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 106.934 -1.506 . . . . 0.19 106.934 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -84.06 142.69 30.24 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.661 -1.275 . . . . 0.2 111.441 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.448 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.4 m95 -75.44 -11.14 59.98 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.216 -0.927 . . . . 0.21 108.995 178.745 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 108.513 -0.921 . . . . 0.49 108.513 179.825 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.707 -0.849 . . . . 1.67 108.707 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -98.18 124.07 42.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.633 -0.877 . . . . 0.31 108.633 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.0 mm -101.16 112.66 34.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.956 -0.757 . . . . 0.19 108.956 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.468 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.0 mp0 -95.53 -0.2 52.36 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.195 -0.94 . . . . 2.25 109.464 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -156.04 159.33 39.04 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.909 -1.119 . . . . 0.15 111.166 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -65.41 -31.92 73.27 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.174 -1.047 . . . . 1.65 108.174 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.8 m -58.01 -49.46 76.76 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.517 -0.873 . . . . 0.23 109.067 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.26 69.24 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.323 -0.86 . . . . 0.17 109.042 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.54 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.7 t80 -58.48 -43.58 89.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.037 -1.039 . . . . 0.14 108.713 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -64.56 -43.87 92.54 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.966 -0.753 . . . . 1.31 108.966 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.59 -36.26 83.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.645 -0.66 . . . . 1.77 110.059 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.32 80.89 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.165 -0.959 . . . . 0.15 109.19 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.54 HD11 ' CE2' ' A' ' 11' ' ' PHE . 75.7 mt -61.14 -41.18 96.27 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.186 -0.946 . . . . 0.17 109.016 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -68.46 -35.26 77.32 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.628 -0.67 . . . . 1.07 110.508 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -39.58 81.18 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.271 -0.893 . . . . 0.18 110.234 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' A' ' 23' ' ' VAL . . . -60.85 -34.6 74.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.386 -0.821 . . . . 0.17 109.746 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -124.58 21.2 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.648 -1.381 . . . . 0.2 109.648 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -90.75 -1.53 57.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 120.982 -1.304 . . . . 1.07 110.51 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -75.02 149.99 39.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.934 -1.104 . . . . 1.5 108.805 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 22' ' ' LEU . 10.8 mt -58.79 160.03 6.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.09 -1.006 . . . . 0.47 110.543 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.4 ' CG2' ' CB ' ' A' ' 18' ' ' ALA . 62.9 t -148.0 111.75 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 107.974 -1.121 . . . . 0.17 107.974 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.409 HG22 ' CD2' ' A' ' 79' ' ' PHE . 59.8 t -103.66 144.19 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 107.47 -1.308 . . . . 0.14 107.47 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.9 t -125.34 122.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.192 -0.942 . . . . 0.13 110.549 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.53 117.41 33.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.377 -0.827 . . . . 1.05 109.932 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -94.12 26.45 3.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.937 . . . . 0.73 110.179 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -60.3 144.65 50.01 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.823 -1.173 . . . . 0.3 110.16 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.553 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.57 125.5 32.49 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.43 -0.952 . . . . 0.22 108.43 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.0 t -65.59 -32.71 74.44 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.105 -0.997 . . . . 0.3 108.729 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.553 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 54.7 p-90 -72.11 -23.22 61.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.196 -0.94 . . . . 0.26 111.03 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 21.5 t -81.05 123.19 28.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.768 -1.207 . . . . 0.26 108.734 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.94 -56.53 22.0 Favored Glycine 0 N--CA 1.493 2.446 0 O-C-N 121.637 -0.664 . . . . 0.23 112.159 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 8.0 Cg_endo -59.94 -29.48 89.5 Favored 'Trans proline' 0 C--N 1.314 -1.267 0 CA-C-N 119.45 1.625 . . . . 0.31 112.605 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.414 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -77.22 -54.99 5.81 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.844 -1.16 . . . . 0.24 109.918 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt -60.26 -39.32 86.36 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.085 -1.009 . . . . 1.59 109.444 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.512 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.3 tmt? -59.76 -28.92 67.8 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.653 -0.654 . . . . 2.1 109.89 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 38' ' ' ILE . 68.0 mt -80.73 -3.7 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.708 -0.62 . . . . 0.49 110.454 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.4 ptmt -65.12 -27.6 2.3 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 120.486 -1.384 . . . . 0.8 113.295 -177.598 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.0 Cg_exo -55.93 -39.27 92.19 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 CA-C-N 122.563 1.951 . . . . 0.28 112.888 -176.227 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.12 -45.01 71.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.632 -1.292 . . . . 0.37 108.842 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.38 -52.81 63.08 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.121 -0.987 . . . . 0.16 109.454 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.0 t60 -68.22 -40.29 82.12 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.774 -0.578 . . . . 0.32 110.678 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.8 m -62.61 -39.62 94.34 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.22 111.374 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -63.92 -19.43 65.1 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.912 -1.117 . . . . 0.22 110.372 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.4 m -55.16 -38.43 68.29 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 120.755 -1.216 . . . . 0.16 108.481 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -83.2 -17.59 42.24 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.031 -1.043 . . . . 2.16 109.635 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -77.93 -35.9 49.96 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.453 -1.314 . . . . 1.78 107.453 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -122.46 68.15 0.95 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.077 -1.453 . . . . 0.25 107.077 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.8 p -66.1 -9.61 32.78 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.642 -0.873 . . . . 0.22 108.642 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -88.91 6.66 38.29 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.056 -1.09 . . . . 1.13 108.056 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 78.7 t -127.05 146.41 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 107.885 -1.154 . . . . 0.24 107.885 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.409 HG22 ' CD1' ' A' ' 55' ' ' LEU . 22.8 mm -99.98 123.84 53.05 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 120.822 -1.174 . . . . 0.15 109.777 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.487 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.2 m-85 -105.72 125.59 51.16 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.273 -0.892 . . . . 0.12 109.179 179.12 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.487 HD12 ' C ' ' A' ' 54' ' ' PHE . 3.2 mp -110.33 141.18 43.71 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.984 -1.073 . . . . 0.22 109.566 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -110.89 131.67 54.85 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 106.517 -1.66 . . . . 1.13 106.517 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.3 t -126.49 137.52 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.404 -0.81 . . . . 0.15 110.097 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.55 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.1 t0 -99.06 119.22 37.46 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 107.821 -1.178 . . . . 1.05 107.821 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -67.99 -18.72 23.94 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 120.66 -1.275 . . . . 0.16 108.469 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.551 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -92.63 -41.19 10.33 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.548 -0.72 . . . . 1.08 111.819 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -96.48 -18.71 19.66 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.596 -1.315 . . . . 1.07 108.062 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -120.44 38.87 3.88 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.569 -1.271 . . . . 0.14 107.569 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -60.34 -23.51 64.31 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.702 -0.624 . . . . 1.47 109.947 -178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.605 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -64.82 -38.13 89.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.696 -1.253 . . . . 1.05 109.216 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.605 HG23 ' OD1' ' A' ' 64' ' ' ASP . 14.2 t -70.89 -44.16 76.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 121.786 0.803 . . . . 0.35 109.618 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.99 -39.71 72.3 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.685 -0.634 . . . . 0.26 110.5 -178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.4 p -59.97 -32.54 70.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.936 -1.102 . . . . 0.24 109.02 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -62.26 -39.04 91.59 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.438 -0.789 . . . . 2.06 108.901 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.22 0.2 57.31 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.559 -0.713 . . . . 0.23 110.923 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 53.29 49.97 18.63 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.996 -1.065 . . . . 2.02 109.684 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.18 133.13 30.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.735 -1.228 . . . . 0.16 108.684 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.2 -10.89 18.42 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.588 -0.695 . . . . 1.6 110.41 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.469 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.18 157.08 20.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.595 -1.316 . . . . 0.14 111.007 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -128.53 155.08 79.38 Favored Pre-proline 0 N--CA 1.501 2.115 0 N-CA-C 107.516 -1.29 . . . . 0.15 107.516 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -75.62 140.83 68.74 Favored 'Cis proline' 0 N--CA 1.493 1.461 0 C-N-CA 123.731 -1.362 . . . . 0.16 113.206 -3.488 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -126.03 137.32 53.64 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.057 -1.09 . . . . 0.13 108.057 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.434 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 90.2 m-85 -115.9 131.1 57.04 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.863 -1.162 . . . . 0.2 107.863 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -123.93 144.65 49.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.281 -0.887 . . . . 0.29 108.916 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.409 ' CD2' HG22 ' A' ' 24' ' ' VAL . 55.6 m-85 -108.23 132.51 53.58 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.639 0.733 . . . . 0.14 110.693 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -126.86 143.37 51.29 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.662 -0.866 . . . . 0.15 108.662 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -146.72 128.37 15.18 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.536 -1.283 . . . . 1.68 107.536 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.2 mttp 59.22 28.22 17.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.467 -0.938 . . . . 1.22 108.467 -178.79 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.11 18.96 79.06 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.742 -1.343 . . . . 0.23 109.742 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -123.71 139.9 53.52 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.389 -1.065 . . . . 2.07 110.957 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -80.03 123.32 27.73 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.846 -0.798 . . . . 1.82 108.846 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.4 m -123.15 9.37 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.513 -0.742 . . . . 0.3 111.122 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.0 160.26 27.24 Favored Glycine 0 N--CA 1.498 2.768 0 C-N-CA 118.795 -1.669 . . . . 0.17 110.948 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.499 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.5 tp10 -169.01 148.0 4.0 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.627 -0.925 . . . . 1.93 109.612 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.499 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 5.6 p90 -168.63 157.39 8.56 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.471 -0.768 . . . . 0.14 109.911 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -128.47 160.09 33.38 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.611 -0.681 . . . . 0.12 109.5 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.511 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.39 143.49 6.33 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.312 -1.515 . . . . 0.12 109.312 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.12 67.64 3.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.05 -1.265 . . . . 0.18 110.207 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -120.82 95.31 4.66 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.478 -0.764 . . . . 0.88 108.985 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -32.21 70.97 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.143 -0.973 . . . . 1.06 111.679 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.89 -29.7 70.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.851 -1.155 . . . . 1.61 109.572 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -60.34 -35.45 75.68 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.46 0.647 . . . . 1.45 109.327 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.0 mt -59.26 -39.85 84.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 122.083 0.945 . . . . 0.19 108.709 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -62.35 -43.68 98.25 Favored 'General case' 0 C--N 1.288 -2.093 0 C-N-CA 120.104 -0.638 . . . . 2.1 110.98 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.29 -43.15 74.42 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.073 -1.017 . . . . 0.19 111.135 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.0 m -64.96 -39.91 94.19 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.825 -1.172 . . . . 0.2 110.147 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.28 -49.25 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.16 108.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.406 ' O ' HG12 ' A' ' 105' ' ' VAL . 25.9 t-20 -60.56 -34.87 74.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.124 0.964 . . . . 0.95 108.653 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.8 tm-20 -67.86 -40.02 83.67 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.427 -0.796 . . . . 2.21 110.037 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.6 mt -100.2 -4.61 29.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.216 -0.928 . . . . 0.25 111.732 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.424 ' OXT' HG13 ' A' ' 105' ' ' VAL . 9.9 p . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.198 -1.564 . . . . 1.08 109.048 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.847 -0.797 . . . . 1.31 108.847 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.511 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.5 mm -131.6 144.8 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.628 0 O-C-N 121.894 -0.504 . . . . 0.15 109.822 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.88 132.08 50.48 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 107.522 -1.288 . . . . 0.19 107.522 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -82.56 140.74 33.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.807 -1.183 . . . . 0.2 111.054 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.469 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.7 m95 -76.97 -7.94 56.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.896 -1.128 . . . . 0.21 108.458 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 . . . . . 0 C--N 1.304 -1.38 0 N-CA-C 108.374 -0.972 . . . . 0.49 108.374 -179.759 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 tptt . . . . . 0 N--CA 1.497 1.875 0 N-CA-C 108.464 -0.939 . . . . 1.67 108.464 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -98.89 122.25 41.89 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.295 -0.878 . . . . 0.31 108.878 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.7 mm -100.06 114.65 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 N-CA-C 108.673 -0.862 . . . . 0.19 108.673 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -99.77 -0.08 40.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.258 -0.902 . . . . 2.25 109.547 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -154.29 156.83 37.7 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.966 -1.084 . . . . 0.15 110.982 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -64.24 -32.21 73.71 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.974 -1.121 . . . . 1.65 107.974 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -56.49 -47.49 79.14 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.539 -0.912 . . . . 0.23 108.539 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.71 -31.6 69.7 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.439 -0.788 . . . . 0.17 109.243 178.8 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.505 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.9 t80 -58.7 -44.66 90.41 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.005 -1.059 . . . . 0.14 109.033 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -64.52 -42.2 95.93 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 108.832 -0.803 . . . . 1.31 108.832 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.58 -36.26 83.66 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.383 0.611 . . . . 1.77 110.399 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.82 77.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.301 -0.874 . . . . 0.15 108.999 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.505 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.5 mt -60.12 -40.05 88.39 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.96 -1.126 . . . . 0.17 107.96 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -69.81 -40.14 76.1 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.55 -0.719 . . . . 1.07 110.264 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.14 -32.37 68.87 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.37 -0.831 . . . . 0.18 110.457 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.59 -26.19 68.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.048 -1.033 . . . . 0.17 108.997 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.17 -130.91 30.04 Favored Glycine 0 N--CA 1.487 2.04 0 N-CA-C 109.8 -1.32 . . . . 0.2 109.8 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.62 3.0 56.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.233 -1.157 . . . . 1.07 110.729 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -73.44 149.49 42.38 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.886 -1.134 . . . . 1.5 109.665 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.645 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -58.52 158.72 7.25 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.056 -1.461 . . . . 0.47 107.056 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.645 ' H ' HD23 ' A' ' 22' ' ' LEU . 85.3 t -143.91 109.69 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 120.93 -1.106 . . . . 0.17 108.816 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.2 t -98.64 141.27 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 108.222 -1.029 . . . . 0.14 108.222 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.9 t -124.17 122.41 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.503 -0.748 . . . . 0.13 109.518 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -99.3 116.45 31.5 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.275 -0.891 . . . . 1.05 109.633 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -92.41 20.43 6.18 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.061 -1.024 . . . . 0.73 109.875 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.29 146.09 20.13 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.735 -1.228 . . . . 0.3 110.483 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.729 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.6 122.4 30.48 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.927 -1.138 . . . . 0.22 107.927 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -63.81 -29.86 71.02 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.062 -1.055 . . . . 0.3 108.582 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.729 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 63.6 p-90 -74.88 -17.88 60.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.312 -0.867 . . . . 0.26 110.694 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -84.76 119.53 25.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.792 -1.193 . . . . 0.26 108.55 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.481 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.97 -54.14 39.33 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.894 -0.67 . . . . 0.23 112.247 -178.236 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.9 Cg_endo -60.18 -29.95 90.21 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 CA-C-N 119.286 1.543 . . . . 0.31 112.426 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.49 -48.01 20.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.051 . . . . 0.24 109.753 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -59.97 -32.48 70.86 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.18 -0.95 . . . . 1.59 109.09 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 15.1 tmm? -59.09 -26.95 65.09 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.34 -0.85 . . . . 2.1 110.041 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.443 HD11 ' HB1' ' A' ' 92' ' ' ALA . 6.0 mt -82.21 -5.72 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.398 -0.814 . . . . 0.49 111.223 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.02 -30.36 7.18 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 119.802 -1.811 . . . . 0.8 113.336 -178.203 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.3 Cg_exo -60.0 -42.46 44.1 Favored 'Trans proline' 0 C--O 1.204 -1.189 0 CA-C-N 121.518 1.578 . . . . 0.28 112.027 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.22 -48.81 60.93 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 118.525 -1.27 . . . . 0.37 109.362 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.16 -52.82 63.7 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.806 0.812 . . . . 0.16 109.775 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -67.87 -40.32 83.61 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.797 -0.564 . . . . 0.32 111.033 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.6 m -64.2 -38.2 90.19 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.77 -1.206 . . . . 0.22 110.777 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.14 -20.5 65.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.141 -0.974 . . . . 0.22 111.142 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -52.95 -40.53 63.74 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 120.824 -1.173 . . . . 0.16 109.075 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -84.92 -16.64 40.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.115 -0.991 . . . . 2.16 109.432 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -76.21 -37.95 57.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.24 -1.393 . . . . 1.78 107.24 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.43 ' C ' ' H ' ' A' ' 51' ' ' ASN . 84.3 m-85 -123.63 68.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.282 -1.377 . . . . 0.25 107.282 177.765 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.3 p -62.81 -5.12 2.52 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.104 -1.073 . . . . 0.22 108.104 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.9 t-20 -80.48 -20.2 44.23 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.921 -0.77 . . . . 1.13 108.921 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 22' ' ' LEU . 62.4 t -109.55 147.61 13.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 N-CA-C 108.465 -0.939 . . . . 0.24 108.465 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -99.77 118.36 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 108.695 -0.854 . . . . 0.15 108.695 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.562 ' C ' HD12 ' A' ' 55' ' ' LEU . 21.1 m-85 -97.43 124.99 41.81 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.021 -1.05 . . . . 0.12 109.798 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.562 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.5 mp -110.07 141.75 42.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.264 -0.898 . . . . 0.22 108.969 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -109.79 130.17 55.55 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.881 -1.526 . . . . 1.13 106.881 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.7 t -125.76 135.48 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.384 -0.822 . . . . 0.15 110.414 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.483 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.4 t0 -97.38 118.87 34.83 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.474 -0.766 . . . . 1.05 109.145 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.9 m -66.12 -20.46 27.3 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 120.584 -1.322 . . . . 0.16 108.392 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.521 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 19.0 m-20 -91.41 -44.05 9.37 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.551 -0.718 . . . . 1.08 112.077 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.434 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 70.4 m-20 -95.21 -14.46 24.05 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.582 -1.324 . . . . 1.07 108.892 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.92 37.82 4.32 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.349 -1.352 . . . . 0.14 107.349 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -59.93 -21.17 60.79 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 121.128 0.49 . . . . 1.47 110.116 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.593 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -65.5 -39.15 91.54 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.906 -1.121 . . . . 1.05 108.482 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.593 HG23 ' OD1' ' A' ' 64' ' ' ASP . 15.4 t -70.95 -45.67 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.434 -0.791 . . . . 0.35 109.527 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -37.42 75.84 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.545 -0.722 . . . . 0.26 110.884 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.2 p -60.56 -38.0 83.11 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.978 -1.077 . . . . 0.24 109.845 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.1 -38.89 92.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.192 -0.942 . . . . 2.06 109.88 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -83.46 -2.97 57.11 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 0.23 109.909 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 55.08 49.84 16.63 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.357 -0.84 . . . . 2.02 109.479 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.39 130.16 27.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.708 -1.197 . . . . 0.16 108.568 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -102.28 -10.98 19.06 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.701 -0.624 . . . . 1.6 110.57 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.482 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.87 155.77 16.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.687 -1.258 . . . . 0.14 110.962 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -129.67 155.32 80.52 Favored Pre-proline 0 N--CA 1.504 2.238 0 N-CA-C 108.563 -0.902 . . . . 0.15 108.563 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -75.38 142.16 73.5 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.882 -1.299 . . . . 0.16 113.073 -2.394 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.482 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 87.2 m -127.3 136.23 51.65 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 108.553 -0.906 . . . . 0.13 108.553 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.626 ' CD1' HD21 ' A' ' 97' ' ' LEU . 92.7 m-85 -114.09 130.14 56.59 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 108.674 -0.861 . . . . 0.2 108.674 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -121.97 140.85 51.95 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.704 -0.85 . . . . 0.29 108.704 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -107.75 132.16 53.68 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.544 0.688 . . . . 0.14 110.887 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -127.21 149.37 50.02 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.472 0.653 . . . . 0.15 109.476 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -149.55 125.13 10.35 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.623 -1.251 . . . . 1.68 107.623 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.2 mttt 58.82 28.41 17.39 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.811 -1.181 . . . . 1.22 107.811 -178.728 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.55 13.51 83.43 Favored Glycine 0 N--CA 1.487 2.073 0 N-CA-C 110.049 -1.22 . . . . 0.23 110.049 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -114.78 134.69 54.91 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.269 -1.136 . . . . 2.07 110.409 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -81.32 121.91 26.79 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.55 -0.907 . . . . 1.82 108.55 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.2 m -125.16 16.33 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.628 -0.67 . . . . 0.3 110.607 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.43 155.47 15.15 Favored Glycine 0 N--CA 1.495 2.624 0 C-N-CA 118.924 -1.607 . . . . 0.17 110.994 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.484 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.3 tp10 -168.0 149.32 5.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.619 -0.882 . . . . 1.93 108.619 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.484 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.0 p90 -168.5 158.86 9.85 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.134 -0.979 . . . . 0.14 109.434 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -127.19 162.33 26.41 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.388 -0.82 . . . . 0.12 110.335 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.487 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.44 142.77 6.46 Favored Glycine 0 N--CA 1.503 3.119 0 N-CA-C 109.985 -1.246 . . . . 0.12 109.985 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.443 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -77.27 64.53 2.69 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.028 -1.278 . . . . 0.18 110.208 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -118.61 97.82 5.93 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.264 -1.013 . . . . 0.88 108.264 178.647 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -32.63 71.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.185 -0.947 . . . . 1.06 111.461 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.46 -30.82 71.88 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.975 -1.078 . . . . 1.61 109.371 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.94 -34.7 75.13 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.323 0.582 . . . . 1.45 109.58 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.626 HD21 ' CD1' ' A' ' 77' ' ' PHE . 58.9 mt -59.53 -37.81 79.34 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.039 0.923 . . . . 0.19 108.574 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -64.09 -42.04 97.07 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 120.3 -0.56 . . . . 2.1 111.425 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -43.94 77.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.961 -1.087 . . . . 0.19 111.565 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -65.75 -38.91 90.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.834 -1.166 . . . . 0.2 109.72 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.93 -49.97 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.041 -1.037 . . . . 0.16 108.405 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.454 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.3 t-20 -60.14 -34.9 74.18 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-O 122.091 0.948 . . . . 0.95 108.458 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -67.91 -39.88 83.51 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.574 -0.703 . . . . 2.21 109.938 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.618 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.8 mt -99.52 -1.69 37.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.202 -0.936 . . . . 0.25 111.414 -179.168 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.475 HG13 ' O ' ' A' ' 105' ' ' VAL . 9.2 p . . . . . 0 N--CA 1.496 1.872 0 O-C-N 120.297 -1.502 . . . . 1.08 109.1 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 109.839 -0.43 . . . . 1.31 109.839 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.487 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.4 mm -128.88 139.86 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 109.462 -0.57 . . . . 0.15 109.462 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.8 m -100.22 127.77 46.43 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -79.47 142.37 35.91 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.811 -1.181 . . . . 0.2 111.161 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.435 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.3 m95 -78.09 -12.19 59.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.254 -0.904 . . . . 0.21 109.435 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 108.263 -1.014 . . . . 0.49 108.263 179.624 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 N--CA 1.5 2.041 0 N-CA-C 108.214 -1.032 . . . . 1.67 108.214 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -97.07 125.23 41.39 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.202 -0.937 . . . . 0.31 109.341 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 mm -103.64 115.76 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 108.663 -0.866 . . . . 0.19 108.663 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -99.32 -0.16 41.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.137 -0.977 . . . . 2.25 109.778 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.87 155.58 37.34 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.726 -1.234 . . . . 0.15 111.068 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -65.0 -31.5 72.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.461 -0.94 . . . . 1.65 108.461 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.5 m -58.65 -47.99 82.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 0.23 109.157 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.74 66.11 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.277 -0.889 . . . . 0.17 109.143 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.504 ' CE2' HD11 ' A' ' 15' ' ' LEU . 50.4 t80 -60.05 -44.37 94.74 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.098 -1.001 . . . . 0.14 108.741 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -64.75 -43.04 94.6 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.855 -0.795 . . . . 1.31 108.855 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.01 -36.49 84.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.203 0.525 . . . . 1.77 110.487 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.08 -42.05 80.96 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.266 -0.896 . . . . 0.15 109.221 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.504 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.6 mt -60.26 -40.1 89.16 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.602 -0.888 . . . . 0.17 108.602 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -67.98 -36.78 80.6 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.485 0.66 . . . . 1.07 110.337 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.71 -39.2 84.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.485 -0.759 . . . . 0.18 110.56 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.89 -32.16 71.62 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.234 -0.916 . . . . 0.17 109.45 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.09 -124.91 17.83 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.809 -1.316 . . . . 0.2 109.809 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -91.77 4.02 53.77 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.109 -1.23 . . . . 1.07 110.367 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -76.2 147.89 38.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.047 -1.033 . . . . 1.5 109.482 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.646 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.25 158.69 8.7 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.249 -1.389 . . . . 0.47 107.249 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.644 ' H ' HD23 ' A' ' 22' ' ' LEU . 88.3 t -146.07 113.09 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.633 -1.292 . . . . 0.17 108.873 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 79' ' ' PHE . 41.1 t -99.69 141.33 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 108.401 -0.962 . . . . 0.14 108.401 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.8 t -124.1 123.72 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.196 -0.94 . . . . 0.13 109.681 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.8 t70 -100.98 116.66 33.34 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.407 -0.808 . . . . 1.05 110.687 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -94.41 24.2 4.68 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.23 -0.919 . . . . 0.73 110.991 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -59.56 149.28 30.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 120.756 -1.215 . . . . 0.3 110.647 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.746 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.06 124.8 32.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.175 -1.417 . . . . 0.22 107.175 178.497 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.35 -30.38 70.76 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 118.896 -1.121 . . . . 0.3 108.042 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.746 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.0 p-90 -75.7 -13.85 60.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.423 -0.798 . . . . 0.26 110.741 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.429 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 23.3 t -85.78 118.3 25.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.745 -1.222 . . . . 0.26 108.225 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.42 -54.08 38.98 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 120.73 -0.748 . . . . 0.23 112.265 -177.944 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.7 Cg_endo -60.44 -29.86 89.6 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 CA-C-N 119.539 1.669 . . . . 0.31 112.183 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -76.2 -47.77 22.87 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.015 -1.053 . . . . 0.24 109.726 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -60.05 -32.11 70.61 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.252 -0.905 . . . . 1.59 109.787 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.409 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 44.6 ttm -59.93 -29.3 68.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.506 -0.746 . . . . 2.1 110.12 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -79.76 -4.52 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.701 -0.624 . . . . 0.49 111.026 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.532 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.53 -31.24 8.53 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 120.188 -1.57 . . . . 0.8 113.712 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.1 Cg_exo -59.63 -38.85 79.19 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 CA-C-N 121.756 1.663 . . . . 0.28 112.159 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -71.23 -50.69 30.36 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 118.763 -1.175 . . . . 0.37 108.894 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -59.97 -47.35 86.18 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.099 -1.001 . . . . 0.16 109.178 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -68.91 -42.37 76.97 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.588 -0.695 . . . . 0.32 111.282 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 66.3 m -65.91 -39.15 90.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.905 -1.122 . . . . 0.22 110.622 -179.23 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.93 -22.46 62.47 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.201 -0.937 . . . . 0.22 110.308 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -56.76 -35.27 68.44 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.855 -1.153 . . . . 0.16 108.835 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -89.48 -12.62 39.57 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.957 -1.089 . . . . 2.16 109.503 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 ttmm -81.84 -36.08 28.68 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.182 -1.414 . . . . 1.78 107.182 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -122.09 67.34 0.92 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 107.284 -1.376 . . . . 0.25 107.284 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 p -63.61 -7.03 6.17 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 107.841 -1.17 . . . . 0.22 107.841 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.19 -20.0 45.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.231 -0.655 . . . . 1.13 109.231 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.544 HG13 ' HB3' ' A' ' 22' ' ' LEU . 78.7 t -110.54 147.69 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 108.881 -0.785 . . . . 0.24 108.881 -178.975 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.0 mm -100.1 120.51 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.2 -0.937 . . . . 0.15 109.325 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.576 ' C ' HD12 ' A' ' 55' ' ' LEU . 24.4 m-85 -98.38 126.97 44.11 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.168 -0.957 . . . . 0.12 110.393 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -110.31 143.69 40.14 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 108.616 -0.883 . . . . 0.22 108.616 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -112.33 129.4 56.31 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 106.809 -1.552 . . . . 1.13 106.809 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.5 t -126.93 133.39 68.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.237 -0.914 . . . . 0.15 110.495 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.521 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 51.5 t0 -96.92 120.07 36.58 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.848 -0.797 . . . . 1.05 108.848 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.92 -18.88 24.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.592 -1.318 . . . . 0.16 107.739 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.2 m-20 -90.45 -43.89 9.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.504 -0.747 . . . . 1.08 111.599 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 23.9 m-20 -95.75 -19.04 19.97 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.625 -1.297 . . . . 1.07 108.81 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -119.61 38.75 3.8 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.641 -1.244 . . . . 0.14 107.641 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -60.08 -22.56 62.89 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.835 -0.541 . . . . 1.47 109.933 -178.502 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.617 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.4 p30 -65.42 -38.32 89.57 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.76 -1.213 . . . . 1.05 108.84 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.617 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -71.41 -44.03 72.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 O-C-N 121.234 -0.916 . . . . 0.35 109.647 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.52 73.59 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.442 -0.787 . . . . 0.26 110.438 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -60.83 -34.0 73.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.922 -1.111 . . . . 0.24 109.446 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -62.47 -37.77 87.26 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.882 . . . . 2.06 109.184 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.25 0.02 57.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.347 -0.845 . . . . 0.23 110.929 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 mp0 53.61 49.85 18.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.946 -1.096 . . . . 2.02 109.025 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.08 134.18 29.12 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 O-C-N 121.0 -1.063 . . . . 0.16 108.441 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -105.44 -12.78 15.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.584 -0.698 . . . . 1.6 110.339 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.61 154.44 18.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.819 -1.176 . . . . 0.14 111.116 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -125.8 156.11 71.73 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.359 -1.349 . . . . 0.15 107.359 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -77.66 142.77 72.11 Favored 'Cis proline' 0 C--N 1.316 -1.17 0 C-N-CA 123.644 -1.399 . . . . 0.16 112.074 -2.177 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.9 134.04 48.11 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 109.245 -0.65 . . . . 0.13 109.245 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.535 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 90.9 m-85 -110.7 130.49 55.56 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.72 -0.845 . . . . 0.2 108.72 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -120.63 140.26 51.81 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.397 -0.964 . . . . 0.29 108.397 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.424 ' CE1' HG21 ' A' ' 100' ' ' THR . 76.0 m-85 -107.71 132.12 53.7 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.466 0.651 . . . . 0.14 110.388 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -125.79 144.11 50.78 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.803 -0.814 . . . . 0.15 108.803 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -147.07 128.51 14.96 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.208 -1.404 . . . . 1.68 107.208 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 mttt 60.01 28.03 17.51 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.129 -1.063 . . . . 1.22 108.129 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.19 21.66 75.32 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 110.133 -1.187 . . . . 0.23 110.133 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -128.72 137.75 51.76 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.291 -1.123 . . . . 2.07 111.012 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -77.43 125.3 29.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.46 -0.775 . . . . 1.82 109.63 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -123.97 9.1 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.617 -0.677 . . . . 0.3 110.887 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.62 154.47 12.31 Favored Glycine 0 N--CA 1.496 2.695 0 C-N-CA 118.424 -1.846 . . . . 0.17 111.538 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -166.54 150.34 7.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.635 -0.921 . . . . 1.93 109.488 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.4 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 27.0 p90 -164.33 161.94 22.05 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.273 -0.971 . . . . 0.14 109.159 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -126.64 159.96 32.1 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.669 0.747 . . . . 0.12 109.539 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.439 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.09 142.85 6.38 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.897 -1.681 . . . . 0.12 108.897 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.98 67.86 4.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.151 -1.205 . . . . 0.18 110.142 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -119.51 97.19 5.53 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.417 -0.957 . . . . 0.88 108.417 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -35.43 77.4 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.098 -1.001 . . . . 1.06 111.335 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -61.81 -29.95 70.5 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.982 -1.074 . . . . 1.61 109.388 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -62.46 -33.61 75.16 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.75 -0.594 . . . . 1.45 109.404 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.42 HD21 ' CD1' ' A' ' 77' ' ' PHE . 38.5 mt -59.27 -39.72 83.8 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.974 -1.121 . . . . 0.19 107.974 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.88 -44.06 97.62 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.456 -0.898 . . . . 2.1 110.907 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.89 75.32 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.89 -1.131 . . . . 0.19 110.732 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.424 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.8 m -64.75 -40.59 95.55 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.833 -1.167 . . . . 0.2 109.015 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 77.6 mt -64.46 -47.85 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 N-CA-C 107.586 -1.264 . . . . 0.16 107.586 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.441 ' O ' HG12 ' A' ' 105' ' ' VAL . 48.5 t30 -59.99 -36.4 77.11 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.48 -0.933 . . . . 0.95 108.48 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -69.33 -40.23 77.71 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.684 -0.635 . . . . 2.21 110.483 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HB2' HD11 ' A' ' 22' ' ' LEU . 94.2 mt -98.22 -2.91 38.61 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.245 -0.91 . . . . 0.25 111.554 -178.514 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.418 -1.426 . . . . 1.08 109.289 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 108.754 -0.832 . . . . 1.31 108.754 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.439 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.6 mm -130.22 140.36 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 109.375 -0.602 . . . . 0.15 109.375 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.8 m -100.83 130.06 46.79 Favored 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 106.779 -1.563 . . . . 0.19 106.779 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.1 m -81.99 145.57 30.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.664 -1.272 . . . . 0.2 111.509 -177.821 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.403 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.7 m95 -80.0 -17.75 52.04 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.411 -0.806 . . . . 0.21 109.563 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 108.176 -1.046 . . . . 0.49 108.176 179.626 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.1 tptp . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 108.916 -0.772 . . . . 1.67 108.916 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.423 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 66.3 tt0 -96.52 124.48 40.52 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.777 -1.194 . . . . 0.31 107.777 178.497 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.9 mm -102.03 115.06 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 0.19 108.893 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.423 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 30.9 mm-40 -99.17 -1.58 38.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.289 -0.882 . . . . 2.25 109.279 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 78.9 p -150.13 152.7 35.14 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.13 -0.981 . . . . 0.15 110.993 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' NZ ' ' CB ' ' A' ' 8' ' ' LYS . 2.9 ttmp? -62.83 -31.02 71.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.54 -0.911 . . . . 1.65 108.54 178.372 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.6 m -58.16 -48.62 79.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.106 -0.996 . . . . 0.23 109.495 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.06 70.56 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.257 -0.902 . . . . 0.17 108.872 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.531 ' CE2' HD11 ' A' ' 15' ' ' LEU . 50.1 t80 -59.79 -44.3 93.99 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.825 . . . . 0.14 109.183 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -65.6 -42.35 91.77 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.69 0.757 . . . . 1.31 109.166 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -64.23 -39.1 93.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.641 -0.662 . . . . 1.77 110.226 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.54 85.13 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.417 -0.802 . . . . 0.15 109.029 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.531 HD11 ' CE2' ' A' ' 11' ' ' PHE . 71.4 mt -60.62 -40.15 90.8 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.239 -0.985 . . . . 0.17 108.357 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -69.52 -36.7 76.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.235 -0.916 . . . . 1.07 109.872 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.95 -36.51 78.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.299 -0.876 . . . . 0.18 110.335 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.75 -33.59 75.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.263 -0.898 . . . . 0.17 109.383 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -124.58 20.44 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.345 -1.102 . . . . 0.2 110.345 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -92.52 3.12 56.12 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.124 -1.221 . . . . 1.07 110.83 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -75.14 150.74 38.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.106 -0.996 . . . . 1.5 108.767 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.694 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.38 155.54 24.93 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.823 -1.177 . . . . 0.47 107.823 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.694 ' H ' HD23 ' A' ' 22' ' ' LEU . 46.8 t -142.84 113.17 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 121.128 -0.983 . . . . 0.17 108.695 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -102.08 140.97 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 107.908 -1.145 . . . . 0.14 107.908 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.98 123.68 67.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.351 -0.843 . . . . 0.13 109.572 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.529 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.4 t70 -100.62 109.25 21.31 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.573 -0.704 . . . . 1.05 110.922 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -91.0 101.28 14.05 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 106.575 -1.639 . . . . 0.73 106.575 176.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -128.14 146.48 50.69 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.326 -0.99 . . . . 0.3 108.326 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.564 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.95 123.63 30.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.164 -1.421 . . . . 0.22 107.164 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.0 -32.09 73.08 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 118.522 -1.271 . . . . 0.3 108.545 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.564 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.2 p-90 -70.57 -26.16 63.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.257 -0.902 . . . . 0.26 110.636 179.313 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -83.78 115.98 22.49 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.959 -1.088 . . . . 0.26 108.134 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.468 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -63.28 -50.05 65.85 Favored Glycine 0 N--CA 1.489 2.182 0 C-N-CA 120.622 -0.799 . . . . 0.23 111.713 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 38.6 Cg_exo -52.13 -35.88 64.17 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 CA-C-N 118.913 1.357 . . . . 0.31 111.98 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.81 -53.83 7.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.434 -0.792 . . . . 0.24 110.029 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ttpp -61.11 -37.21 81.96 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.06 -1.025 . . . . 1.59 109.867 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.497 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.6 tmm? -59.2 -28.17 66.41 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.569 -0.707 . . . . 2.1 109.878 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 38' ' ' ILE . 72.9 mt -81.69 -3.86 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.838 -0.539 . . . . 0.49 111.332 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -64.88 -27.6 2.37 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 120.368 -1.458 . . . . 0.8 113.865 -178.022 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.2 Cg_exo -56.15 -40.69 83.23 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 CA-C-N 122.215 1.827 . . . . 0.28 112.604 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -67.92 -45.21 75.01 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 117.817 -1.553 . . . . 0.37 107.877 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -60.29 -53.43 57.79 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.255 -0.903 . . . . 0.16 110.177 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -68.23 -40.09 82.13 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.517 -0.739 . . . . 0.32 110.598 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 70.0 m -62.21 -38.96 91.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.093 -1.004 . . . . 0.22 110.096 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.13 -27.28 68.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.174 -0.954 . . . . 0.22 110.105 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.7 m -50.72 -38.48 47.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.864 -1.147 . . . . 0.16 109.424 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -83.3 -13.17 55.72 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.967 -1.083 . . . . 2.16 109.377 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.457 ' HZ2' ' HB2' ' A' ' 48' ' ' LYS . 4.4 ttmp? -82.05 -36.91 27.22 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.705 -1.22 . . . . 1.78 107.705 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -123.44 65.82 1.01 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 106.509 -1.663 . . . . 0.25 106.509 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.9 p -62.56 -8.87 7.12 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.154 -1.054 . . . . 0.22 108.154 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -89.9 8.44 32.18 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 1.13 108.48 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.2 t -127.27 148.93 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 107.698 -1.223 . . . . 0.24 107.698 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' CD1' ' A' ' 55' ' ' LEU . 21.9 mm -99.88 121.08 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.049 -1.032 . . . . 0.15 109.945 -178.311 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.525 ' C ' HD12 ' A' ' 55' ' ' LEU . 55.6 m-85 -104.45 124.6 49.54 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.201 -0.937 . . . . 0.12 109.909 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.525 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.9 mp -110.5 143.62 40.58 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.952 -1.092 . . . . 0.22 109.833 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -112.8 130.05 56.22 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.74 -1.578 . . . . 1.13 106.74 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.08 140.43 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.916 0.865 . . . . 0.15 111.537 -177.458 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.489 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.3 t0 -102.7 118.07 36.03 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.633 -0.877 . . . . 1.05 108.633 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.0 m -69.73 -15.09 19.04 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 120.697 -1.252 . . . . 0.16 108.794 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.403 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.6 m-20 -95.42 -41.69 8.86 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.457 -0.777 . . . . 1.08 111.047 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 59.1 m-20 -97.53 -18.66 18.85 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.072 -1.018 . . . . 1.07 108.552 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.66 39.15 4.0 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 107.223 -1.399 . . . . 0.14 107.223 178.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.588 ' CD ' ' H ' ' A' ' 63' ' ' GLN . 0.0 OUTLIER -60.16 -22.96 63.53 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.779 -0.646 . . . . 1.47 110.019 -178.927 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.632 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -63.2 -36.21 82.87 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.943 -1.098 . . . . 1.05 109.202 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.632 HG23 ' OD1' ' A' ' 64' ' ' ASP . 13.8 t -73.64 -43.91 53.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.465 -0.772 . . . . 0.35 109.71 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.33 -39.06 68.47 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.768 -0.582 . . . . 0.26 111.309 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.3 p -60.21 -38.78 84.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.978 -1.076 . . . . 0.24 109.946 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.91 -36.5 84.13 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 2.06 109.206 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.03 -0.63 55.07 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.395 -0.816 . . . . 0.23 111.194 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.69 49.84 17.16 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.939 -1.101 . . . . 2.02 109.785 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.6 t -65.38 130.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 C-N-CA 118.329 -1.348 . . . . 0.16 108.276 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -102.15 -12.71 17.85 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.72 -0.613 . . . . 1.6 110.237 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.477 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.82 156.21 17.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.746 -1.221 . . . . 0.14 110.814 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.42 HG23 ' NE1' ' B' ' 67' ' ' TRP . 36.6 p -129.74 154.27 80.96 Favored Pre-proline 0 N--CA 1.504 2.23 0 N-CA-C 108.06 -1.089 . . . . 0.15 108.06 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -74.8 144.95 82.59 Favored 'Cis proline' 0 N--CA 1.496 1.665 0 C-N-CA 123.811 -1.329 . . . . 0.16 112.435 -2.49 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -130.33 136.12 48.79 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 108.57 -0.9 . . . . 0.13 108.57 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.84 ' CD1' HD21 ' A' ' 97' ' ' LEU . 88.5 m-85 -109.68 129.54 55.59 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.663 -0.648 . . . . 0.2 109.313 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -121.96 137.58 54.74 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.683 -0.858 . . . . 0.29 108.683 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -105.26 133.77 49.48 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.735 -0.603 . . . . 0.14 110.271 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -127.43 143.96 51.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.15 109.357 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -145.92 127.13 14.77 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 107.868 -1.16 . . . . 1.68 107.868 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.2 mttt 59.75 28.51 17.98 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.211 -1.033 . . . . 1.22 108.211 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.07 22.52 73.79 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.757 -1.337 . . . . 0.23 109.757 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 41.1 mm-40 -127.75 137.26 52.37 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.347 -1.09 . . . . 2.07 110.61 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -81.04 126.31 31.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.202 -0.936 . . . . 1.82 109.76 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.26 8.33 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.671 -0.643 . . . . 0.3 110.399 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.89 155.98 16.86 Favored Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.626 -1.749 . . . . 0.17 111.815 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -166.16 149.18 7.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.92 -0.753 . . . . 1.93 109.454 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.42 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 20.6 p90 -164.15 160.68 21.68 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.08 -1.048 . . . . 0.14 109.459 177.927 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -124.96 162.79 23.72 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.615 0.722 . . . . 0.12 109.86 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.523 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.55 137.57 5.53 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.135 -1.586 . . . . 0.12 109.135 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.469 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.02 67.78 2.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.179 -1.189 . . . . 0.18 110.232 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -119.21 100.12 7.13 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.256 -1.016 . . . . 0.88 108.256 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.89 -34.7 73.89 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.492 -0.755 . . . . 1.06 112.36 -178.413 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.03 -29.89 71.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.538 -1.351 . . . . 1.61 109.553 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.83 -38.38 81.87 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.926 -0.768 . . . . 1.45 108.926 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.84 HD21 ' CD1' ' A' ' 77' ' ' PHE . 42.9 mt -57.76 -39.88 78.43 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.853 0.835 . . . . 0.19 108.929 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.81 -41.59 99.36 Favored 'General case' 0 C--N 1.293 -1.873 0 C-N-CA 119.825 -0.75 . . . . 2.1 110.611 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.01 77.28 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.106 -0.996 . . . . 0.19 111.861 -178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -39.58 93.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 120.544 -1.348 . . . . 0.2 109.67 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.5 mt -61.05 -49.9 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.101 -0.999 . . . . 0.16 108.818 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 105' ' ' VAL . 24.0 t-20 -60.18 -34.39 73.53 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.32 -0.992 . . . . 0.95 108.32 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -67.83 -38.5 83.28 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.696 -0.627 . . . . 2.21 109.752 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.621 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.5 mt -101.99 -0.13 34.23 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.299 -0.875 . . . . 0.25 111.56 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.3 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 1.08 109.232 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.1 mmtt . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.49 -0.559 . . . . 1.31 109.49 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.523 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.1 mm -130.25 140.47 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.865 -0.522 . . . . 0.15 110.057 -179.266 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 59.9 m -98.15 124.64 42.8 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 107.325 -1.361 . . . . 0.19 107.325 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 60.9 m -77.65 141.55 39.36 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.942 -1.098 . . . . 0.2 111.575 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.42 ' NE1' HG23 ' A' ' 74' ' ' THR . 21.5 m95 -76.38 -9.57 58.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.21 109.274 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 22.2 m-20 . . . . . 0 N--CA 1.487 1.38 0 O-C-N 121.109 -0.994 . . . . 0.49 108.715 -179.893 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.9 tptt . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 108.617 -0.883 . . . . 1.67 108.617 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -99.35 122.86 43.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.348 -0.845 . . . . 0.31 108.886 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.69 115.25 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.372 -0.83 . . . . 0.19 108.792 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.457 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 53.4 mp0 -97.52 -0.71 45.5 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.376 -0.827 . . . . 2.25 109.415 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -154.0 153.11 31.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.021 -1.049 . . . . 0.15 111.198 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.84 -32.4 73.61 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.445 -0.946 . . . . 1.65 108.445 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.3 m -58.96 -46.44 88.06 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.999 -1.111 . . . . 0.23 107.999 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.92 -30.7 69.22 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.634 -0.876 . . . . 0.17 108.634 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.515 ' CE2' HD11 ' A' ' 15' ' ' LEU . 53.7 t80 -59.83 -43.79 94.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.109 -0.994 . . . . 0.14 108.964 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -65.36 -41.29 94.0 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.831 -0.803 . . . . 1.31 108.831 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.9 -35.34 79.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.663 -0.648 . . . . 1.77 110.237 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.81 82.92 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.284 -0.885 . . . . 0.15 109.234 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.515 HD11 ' CE2' ' A' ' 11' ' ' PHE . 69.3 mt -61.52 -40.39 94.45 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.334 -0.854 . . . . 0.17 108.807 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -70.05 -36.83 75.29 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.417 -0.802 . . . . 1.07 110.185 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.11 90.14 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.361 -0.837 . . . . 0.18 110.338 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -32.66 71.52 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.381 -0.824 . . . . 0.17 109.847 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.08 -126.8 23.75 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.31 -1.116 . . . . 0.2 110.31 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -91.75 5.27 50.45 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.892 -1.358 . . . . 1.07 110.978 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -77.58 151.83 34.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.128 -0.983 . . . . 1.5 109.469 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.677 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -61.03 156.91 16.76 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.489 -1.3 . . . . 0.47 107.489 179.78 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.675 ' H ' HD23 ' A' ' 22' ' ' LEU . 77.8 t -143.75 117.99 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.856 -1.153 . . . . 0.17 108.859 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.0 142.08 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 107.813 -1.18 . . . . 0.14 107.813 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.45 123.76 66.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.351 -0.843 . . . . 0.13 109.205 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.473 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.1 t70 -100.82 118.1 36.22 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.473 -0.767 . . . . 1.05 109.633 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -95.18 22.8 6.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.306 -0.871 . . . . 0.73 109.902 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.3 m -59.04 148.01 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.027 -1.045 . . . . 0.3 110.779 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.583 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.13 123.82 32.6 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.074 -1.084 . . . . 0.22 108.074 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.0 t -65.26 -34.51 78.52 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 118.916 -1.114 . . . . 0.3 108.192 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.583 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.0 p-90 -70.12 -23.28 63.0 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.218 -0.927 . . . . 0.26 111.003 179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.2 t -82.68 112.89 19.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.734 -1.229 . . . . 0.26 107.992 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.455 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.85 -50.58 66.17 Favored Glycine 0 N--CA 1.489 2.211 0 C-N-CA 120.329 -0.939 . . . . 0.23 111.246 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.1 Cg_exo -51.45 -37.82 62.51 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 CA-C-N 119.011 1.406 . . . . 0.31 111.958 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.444 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.49 -47.5 19.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.057 -1.027 . . . . 0.24 109.909 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.54 -31.52 69.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.135 -0.978 . . . . 1.59 109.127 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.511 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -59.91 -29.74 68.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.473 -0.767 . . . . 2.1 109.967 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.558 HD11 ' HB1' ' A' ' 92' ' ' ALA . 15.5 mt -80.78 -5.07 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.523 -0.736 . . . . 0.49 111.325 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.526 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.28 -31.52 9.36 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 119.988 -1.695 . . . . 0.8 113.669 -176.857 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -59.9 -37.46 85.66 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 CA-C-N 121.898 1.714 . . . . 0.28 112.067 -178.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -71.62 -51.4 23.41 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 118.371 -1.332 . . . . 0.37 108.175 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.87 -46.7 88.46 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.38 -0.825 . . . . 0.16 109.039 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.14 -45.65 73.02 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.493 -0.755 . . . . 0.32 110.846 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.7 m -61.62 -39.92 93.0 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.085 -1.009 . . . . 0.22 111.154 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.6 mt -61.33 -22.31 64.79 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.269 -0.894 . . . . 0.22 110.852 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -55.51 -38.25 68.96 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 120.981 -1.074 . . . . 0.16 108.714 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -86.21 -16.66 37.03 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.251 -0.905 . . . . 2.16 109.263 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -76.58 -35.75 57.96 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.325 -1.361 . . . . 1.78 107.325 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -123.9 67.92 1.04 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 107.552 -1.277 . . . . 0.25 107.552 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.7 p -64.06 -7.73 9.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.578 -0.897 . . . . 0.22 108.578 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -89.16 5.48 44.46 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.115 -1.069 . . . . 1.13 108.115 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.473 HG13 ' HB3' ' A' ' 22' ' ' LEU . 44.4 t -128.0 143.08 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 N-CA-C 107.605 -1.257 . . . . 0.24 107.605 178.796 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.5 mm -99.21 122.55 51.1 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.913 -1.117 . . . . 0.15 109.203 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.599 ' C ' HD12 ' A' ' 55' ' ' LEU . 29.8 m-85 -100.76 129.01 46.59 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.298 -0.876 . . . . 0.12 109.219 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.599 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -112.52 141.52 46.19 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.357 -0.839 . . . . 0.22 109.138 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -109.94 132.62 53.99 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.673 -1.603 . . . . 1.13 106.673 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -130.45 132.0 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.27 -0.894 . . . . 0.15 110.26 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.665 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.6 t0 -95.64 120.96 36.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 1.05 108.52 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.87 -20.52 26.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 120.659 -1.276 . . . . 0.16 107.989 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.543 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.1 m-20 -90.25 -43.2 10.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.618 -0.676 . . . . 1.08 111.506 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.411 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 72.4 m-20 -95.75 -14.2 23.54 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.561 -1.337 . . . . 1.07 108.237 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.665 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 39.72 3.9 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.21 -1.404 . . . . 0.14 107.21 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -60.08 -26.93 66.58 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.628 -0.67 . . . . 1.47 109.362 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.537 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -65.33 -37.48 87.21 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.029 -1.044 . . . . 1.05 108.969 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.537 HG23 ' OD1' ' A' ' 64' ' ' ASP . 7.6 t -70.28 -47.26 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.236 -0.915 . . . . 0.35 109.797 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.33 -36.92 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.446 -0.784 . . . . 0.26 110.788 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -61.07 -32.59 72.23 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.027 -1.046 . . . . 0.24 109.57 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.9 -35.73 80.68 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.246 -0.908 . . . . 2.06 109.283 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.467 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -88.02 -0.22 56.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.281 -0.887 . . . . 0.23 110.857 -178.952 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 54.62 50.06 16.77 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.056 -1.027 . . . . 2.02 109.954 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.2 t -67.45 132.38 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 120.938 -1.101 . . . . 0.16 108.731 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -104.6 -12.63 16.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.671 -0.643 . . . . 1.6 110.66 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.8 153.42 16.77 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.499 -1.376 . . . . 0.14 110.841 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -124.84 155.26 70.43 Favored Pre-proline 0 N--CA 1.501 2.122 0 N-CA-C 108.038 -1.097 . . . . 0.15 108.038 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -76.44 143.16 75.38 Favored 'Cis proline' 0 N--CA 1.493 1.457 0 C-N-CA 123.844 -1.315 . . . . 0.16 112.538 -2.914 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.9 m -128.97 136.12 49.92 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.11 -0.7 . . . . 0.13 109.11 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.756 ' CD1' HD21 ' A' ' 97' ' ' LEU . 93.8 m-85 -112.01 129.64 56.13 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.778 -0.823 . . . . 0.2 108.778 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.467 HE22 ' HB1' ' A' ' 69' ' ' ALA . 63.0 mt-30 -121.49 137.75 54.59 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.843 -1.169 . . . . 0.29 107.843 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -105.56 134.59 48.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.722 -0.611 . . . . 0.14 110.978 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -128.1 148.99 50.6 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.47 0.653 . . . . 0.15 109.546 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -150.74 125.62 9.79 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.74 -1.207 . . . . 1.68 107.74 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 55.1 mttp 60.03 28.17 17.68 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 108.956 -0.757 . . . . 1.22 108.956 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.2 21.46 70.38 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.113 -1.195 . . . . 0.23 110.113 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -129.51 140.21 51.32 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.328 -1.101 . . . . 2.07 110.596 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -77.79 129.12 35.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.551 -0.718 . . . . 1.82 109.063 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.4 m -123.24 8.03 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.683 -0.636 . . . . 0.3 110.39 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.81 14.6 Favored Glycine 0 N--CA 1.497 2.704 0 C-N-CA 118.433 -1.842 . . . . 0.17 112.059 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -164.13 149.44 10.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 122.005 -0.703 . . . . 1.93 109.87 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 8.2 p90 -163.81 159.57 21.37 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.389 -0.82 . . . . 0.14 109.967 177.693 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.4 p -126.2 160.46 30.2 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.867 0.842 . . . . 0.12 110.253 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.492 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.34 140.78 5.6 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.652 -1.779 . . . . 0.12 108.652 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.558 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.32 62.91 3.8 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.184 -1.186 . . . . 0.18 110.193 -179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.4 t-20 -117.48 101.82 8.69 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.89 -1.152 . . . . 0.88 107.89 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.453 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.32 -31.45 69.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.484 -0.76 . . . . 1.06 111.747 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.94 -29.56 69.46 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.721 -1.237 . . . . 1.61 109.551 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.429 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 74.4 tttt -60.07 -34.09 72.97 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 108.353 -0.98 . . . . 1.45 108.353 -179.25 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.756 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.1 mt -59.87 -40.04 87.3 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.61 -0.885 . . . . 0.19 108.61 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -63.09 -42.4 99.61 Favored 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.916 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.55 78.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.185 -0.947 . . . . 0.19 111.278 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.04 -39.31 90.06 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 120.753 -1.217 . . . . 0.2 109.873 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.4 mt -61.38 -47.49 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.001 -1.062 . . . . 0.16 108.511 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.499 ' O ' HG12 ' A' ' 105' ' ' VAL . 18.9 t-20 -60.41 -35.63 76.24 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 121.821 0.82 . . . . 0.95 108.922 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.29 -39.72 86.01 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.75 -0.594 . . . . 2.21 109.886 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 22' ' ' LEU . 73.4 mt -99.35 -2.65 35.78 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.236 -0.915 . . . . 0.25 111.046 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.3 p . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.521 -1.362 . . . . 1.08 109.019 -179.373 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.283 -0.636 . . . . 1.31 109.283 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.492 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.1 mm -129.29 140.1 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 121.813 -0.555 . . . . 0.15 109.821 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.6 m -101.64 132.15 47.47 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.725 -1.213 . . . . 0.19 107.725 178.072 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.0 m -81.66 141.55 33.54 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.726 -1.234 . . . . 0.2 110.994 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.465 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.6 m95 -76.21 -12.55 60.11 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.292 -0.88 . . . . 0.21 108.904 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 . . . . . 0 C--N 1.303 -1.43 0 N-CA-C 108.36 -0.978 . . . . 0.49 108.36 179.61 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.4 tptt . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 107.83 -1.174 . . . . 1.67 107.83 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -96.55 122.62 39.66 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.847 -0.798 . . . . 0.31 108.847 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.9 111.95 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 108.487 -0.931 . . . . 0.19 108.487 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.458 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.9 mp0 -95.65 -0.44 51.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.138 -0.976 . . . . 2.25 109.844 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.58 156.3 34.85 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.79 -1.194 . . . . 0.15 111.782 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -61.87 -31.7 71.99 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.225 -1.028 . . . . 1.65 108.225 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.408 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 60.0 m -58.51 -49.91 75.67 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.503 -0.879 . . . . 0.23 108.818 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.03 67.59 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.933 -0.766 . . . . 0.17 108.933 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.579 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.9 t80 -59.75 -44.52 93.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 0.14 109.351 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -65.01 -44.02 90.56 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.424 -0.797 . . . . 1.31 109.305 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.533 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.84 -39.45 94.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.704 -0.623 . . . . 1.77 110.414 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.19 95.36 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.374 -0.829 . . . . 0.15 109.057 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.579 HD11 ' CE2' ' A' ' 11' ' ' PHE . 35.6 mt -60.25 -41.06 92.42 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.315 -0.866 . . . . 0.17 109.011 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -70.02 -36.16 74.87 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.359 -0.838 . . . . 1.07 110.474 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.46 78.71 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.132 -0.98 . . . . 0.18 110.965 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.62 -31.48 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.897 -1.127 . . . . 0.17 109.675 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.95 -124.67 20.83 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.989 -1.244 . . . . 0.2 109.989 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.426 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 65.2 m-20 -91.85 0.33 57.49 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.999 -1.294 . . . . 1.07 110.706 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -74.78 150.1 39.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.838 -1.164 . . . . 1.5 109.646 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 22' ' ' LEU . 8.2 mt -57.39 159.94 4.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.961 -1.087 . . . . 0.47 109.316 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.1 t -146.65 107.92 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 108.102 -1.073 . . . . 0.17 108.102 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.449 HG22 ' CD2' ' A' ' 79' ' ' PHE . 47.6 t -102.46 136.26 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 N-CA-C 107.595 -1.261 . . . . 0.14 107.595 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.9 t -118.18 123.05 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.201 -0.937 . . . . 0.13 109.742 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -98.97 119.78 38.31 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 1.05 109.928 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -97.85 24.91 6.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.23 -0.919 . . . . 0.73 110.401 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -59.88 148.26 35.49 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.036 -1.04 . . . . 0.3 110.403 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.587 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.39 124.54 32.11 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.687 -1.227 . . . . 0.22 107.687 178.623 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.09 -33.61 74.86 Favored 'General case' 0 C--N 1.298 -1.638 0 C-N-CA 118.877 -1.129 . . . . 0.3 108.703 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.587 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.4 p-90 -69.95 -21.63 63.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.147 -0.971 . . . . 0.26 110.447 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.1 t -84.59 112.01 20.04 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.974 -1.079 . . . . 0.26 108.342 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.431 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.92 -52.05 55.57 Favored Glycine 0 N--CA 1.491 2.349 0 C-N-CA 120.862 -0.685 . . . . 0.23 111.64 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -51.23 -35.28 52.21 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 CA-C-N 119.062 1.431 . . . . 0.31 111.72 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.66 17.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.587 -0.696 . . . . 0.24 109.816 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.0 -32.15 70.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.28 -0.887 . . . . 1.59 109.533 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 19.1 ttt -59.81 -27.76 66.87 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 2.1 108.998 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.405 HG22 ' O ' ' A' ' 38' ' ' ILE . 19.5 mt -82.2 -7.72 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.782 -0.574 . . . . 0.49 111.868 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.93 -31.13 8.6 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 119.858 -1.776 . . . . 0.8 114.168 -177.472 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.9 Cg_exo -58.61 -38.61 88.63 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.616 1.613 . . . . 0.28 112.579 -178.06 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -69.29 -51.07 40.9 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 118.773 -1.171 . . . . 0.37 108.954 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.63 -50.81 72.44 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.248 -0.908 . . . . 0.16 109.508 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -67.47 -44.24 79.07 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.744 -0.597 . . . . 0.32 111.522 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.453 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.5 -37.1 84.73 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.953 -1.092 . . . . 0.22 110.496 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.73 -25.42 67.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.22 110.315 -178.584 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.0 m -51.62 -38.35 54.27 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.075 -1.016 . . . . 0.16 108.633 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -85.87 -17.03 36.72 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.4 -0.812 . . . . 2.16 109.415 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -77.66 -37.34 50.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 107.594 -1.261 . . . . 1.78 107.594 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -121.85 67.25 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 106.699 -1.593 . . . . 0.25 106.699 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.5 p -63.44 -10.1 15.74 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.856 -0.794 . . . . 0.22 108.856 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -90.99 8.84 33.26 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.6 -0.889 . . . . 1.13 108.6 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 70.0 t -127.12 145.72 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 107.406 -1.331 . . . . 0.24 107.406 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.31 120.61 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 120.978 -1.076 . . . . 0.15 109.989 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.5 ' C ' HD12 ' A' ' 55' ' ' LEU . 47.6 m-85 -102.96 127.78 50.05 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.006 -1.059 . . . . 0.12 109.891 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.5 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -110.06 141.4 42.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.984 -1.073 . . . . 0.22 109.489 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -110.14 132.88 53.77 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.316 -1.364 . . . . 1.13 107.316 178.16 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 39.6 t -130.23 131.92 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.157 -0.964 . . . . 0.15 110.839 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.617 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.9 t0 -95.2 119.97 34.62 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.135 -1.061 . . . . 1.05 108.135 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.11 -20.1 25.37 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 C-N-CA 118.749 -1.181 . . . . 0.16 108.532 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.9 m-20 -91.72 -41.36 10.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.486 -0.759 . . . . 1.08 111.806 -178.917 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -95.91 -14.78 22.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 120.408 -1.433 . . . . 1.07 108.236 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.98 38.9 4.09 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.601 -1.259 . . . . 0.14 107.601 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -59.84 -26.58 65.92 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 109.414 -0.587 . . . . 1.47 109.414 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.12 -36.29 83.56 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.804 -1.185 . . . . 1.05 109.495 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.461 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.2 t -73.26 -43.12 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 120.961 -1.087 . . . . 0.35 109.694 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.9 -37.83 67.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.379 -0.826 . . . . 0.26 110.394 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 84.8 p -60.99 -33.91 73.98 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.09 -1.007 . . . . 0.24 108.467 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -60.64 -40.02 90.41 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.538 -0.726 . . . . 2.06 109.056 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.18 4.58 50.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.331 -0.856 . . . . 0.23 110.869 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 52.25 50.13 19.06 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.884 -1.135 . . . . 2.02 110.545 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.35 132.13 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.778 -1.201 . . . . 0.16 108.87 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -103.92 -9.89 18.58 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.719 -0.613 . . . . 1.6 109.611 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.516 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.45 155.79 20.33 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.772 -1.205 . . . . 0.14 111.772 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -126.04 154.3 73.98 Favored Pre-proline 0 N--CA 1.499 1.976 0 N-CA-C 107.566 -1.272 . . . . 0.15 107.566 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -78.86 140.06 56.93 Favored 'Cis proline' 0 N--CA 1.487 1.144 0 C-N-CA 123.657 -1.393 . . . . 0.16 111.97 -2.067 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -124.22 132.89 53.63 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.885 -0.783 . . . . 0.13 108.885 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.524 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.6 m-85 -110.67 131.48 55.01 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.938 -0.764 . . . . 0.2 108.938 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -121.63 140.4 52.31 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.605 -0.887 . . . . 0.29 108.605 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.449 ' CD2' HG22 ' A' ' 24' ' ' VAL . 66.5 m-85 -107.87 131.15 54.8 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.397 0.617 . . . . 0.14 109.679 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -125.62 148.98 48.78 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 109.082 -0.71 . . . . 0.15 109.082 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -147.31 127.74 14.03 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.182 -1.414 . . . . 1.68 107.182 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.426 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 40.4 mttm 56.09 33.26 21.62 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.057 -1.027 . . . . 1.22 108.89 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.56 24.72 76.45 Favored Glycine 0 N--CA 1.484 1.883 0 N-CA-C 109.82 -1.312 . . . . 0.23 109.82 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -129.23 135.92 49.43 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.513 -0.993 . . . . 2.07 110.809 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -73.69 129.99 39.07 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.093 -1.004 . . . . 1.82 109.651 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.0 10.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.864 -0.523 . . . . 0.3 110.09 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 164.01 161.78 13.77 Favored Glycine 0 N--CA 1.496 2.658 0 C-N-CA 118.373 -1.87 . . . . 0.17 112.051 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -165.25 154.65 12.65 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.872 -0.781 . . . . 1.93 109.325 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 5.8 p90 -166.92 157.03 11.38 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.886 -0.726 . . . . 0.14 109.355 178.465 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -125.54 160.91 28.38 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.608 -0.682 . . . . 0.12 109.418 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.461 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.7 143.34 6.11 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.532 -1.827 . . . . 0.12 108.532 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.15 64.04 4.85 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.171 -1.193 . . . . 0.18 109.146 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -116.83 98.4 6.48 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 108.336 -0.987 . . . . 0.88 108.336 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -34.77 72.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.448 -0.782 . . . . 1.06 111.312 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -62.57 -29.37 70.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.206 -0.934 . . . . 1.61 109.257 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -60.9 -37.62 82.87 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.603 -0.686 . . . . 1.45 109.149 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.05 -39.79 83.11 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.232 -1.025 . . . . 0.19 108.232 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.37 -44.01 96.02 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.051 -0.66 . . . . 2.1 110.503 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.64 -44.08 62.37 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.966 -1.084 . . . . 0.19 111.318 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.4 m -63.2 -40.03 96.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.644 -1.285 . . . . 0.2 109.739 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 69.2 mt -62.1 -50.09 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.221 -0.924 . . . . 0.16 108.551 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.402 ' O ' HG12 ' A' ' 105' ' ' VAL . 21.9 t-20 -60.87 -34.35 74.48 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 122.023 0.916 . . . . 0.95 108.758 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -67.61 -39.87 84.74 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.525 -0.734 . . . . 2.21 110.208 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 75.8 mt -101.3 -3.13 29.46 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.019 -1.051 . . . . 0.25 111.493 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.6 p . . . . . 0 N--CA 1.5 2.036 0 O-C-N 120.392 -1.442 . . . . 1.08 109.678 -179.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.541 -0.54 . . . . 1.31 109.541 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.461 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.9 mm -130.0 140.78 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 N-CA-C 109.592 -0.521 . . . . 0.15 109.592 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 16.9 m -101.61 129.49 47.74 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 107.159 -1.423 . . . . 0.19 107.159 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.5 m -81.15 143.93 32.03 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.887 -1.133 . . . . 0.2 111.802 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.516 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 27.6 m95 -76.79 -10.92 59.71 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.052 -1.03 . . . . 0.21 109.24 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 41.4 m-20 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 108.625 -0.88 . . . . 0.49 108.625 179.821 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.418 -0.956 . . . . 1.67 108.418 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -94.91 125.31 39.49 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.166 -0.959 . . . . 0.31 109.265 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.4 mm -100.56 116.36 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.404 -0.961 . . . . 0.19 108.404 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -99.64 -2.8 34.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.396 -0.815 . . . . 2.25 109.433 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -152.57 155.99 38.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 119.257 -0.977 . . . . 0.15 111.189 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -62.33 -33.81 75.42 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.924 -1.139 . . . . 1.65 107.924 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.2 m -56.0 -49.39 73.77 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 118.962 -1.095 . . . . 0.23 108.96 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.24 69.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.665 -0.865 . . . . 0.17 108.665 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.55 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.1 t80 -59.77 -43.14 94.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.023 -1.048 . . . . 0.14 109.069 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -65.49 -41.61 93.08 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 108.33 -0.989 . . . . 1.31 108.33 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -66.57 -35.73 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.785 -0.572 . . . . 1.77 109.941 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.919 . . . . 0.15 108.746 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.55 HD11 ' CE2' ' A' ' 11' ' ' PHE . 55.3 mt -61.37 -42.66 99.07 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.419 -0.956 . . . . 0.17 108.419 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -68.49 -37.08 79.79 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.622 -0.674 . . . . 1.07 110.053 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.61 -38.63 84.22 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.336 -0.852 . . . . 0.18 109.64 -179.224 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.82 69.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.119 -0.988 . . . . 0.17 110.331 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -128.05 26.05 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.276 -1.13 . . . . 0.2 110.276 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -91.65 3.48 54.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.141 -1.211 . . . . 1.07 109.957 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.4 mttp -75.16 149.16 39.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.022 -1.048 . . . . 1.5 109.44 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.08 154.9 18.23 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.752 -1.203 . . . . 0.47 107.752 -179.637 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.611 ' H ' HD23 ' A' ' 22' ' ' LEU . 92.5 t -142.57 109.75 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.996 -1.065 . . . . 0.17 108.99 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.3 t -100.12 141.16 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 107.783 -1.191 . . . . 0.14 107.783 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -123.42 121.69 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 O-C-N 120.893 -1.13 . . . . 0.13 109.978 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.563 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.55 121.72 40.85 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.359 -0.838 . . . . 1.05 110.11 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -97.13 21.36 9.97 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.126 -0.984 . . . . 0.73 110.226 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.408 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 52.3 m -54.16 147.06 13.65 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.045 -1.034 . . . . 0.3 111.306 -178.627 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.559 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.94 126.19 33.3 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.843 -1.169 . . . . 0.22 107.843 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.413 HG23 ' N ' ' A' ' 31' ' ' TRP . 7.8 t -66.93 -36.56 82.52 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.646 -1.284 . . . . 0.3 108.477 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.559 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.3 p-90 -69.9 -22.6 63.21 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.333 -0.854 . . . . 0.26 111.761 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.9 t -83.77 118.39 23.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.715 -1.241 . . . . 0.26 108.806 -179.275 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.409 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.06 -54.39 37.14 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 120.1 -1.048 . . . . 0.23 111.074 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 38.5 Cg_exo -50.69 -38.58 56.21 Favored 'Trans proline' 0 C--N 1.309 -1.549 0 CA-C-N 119.074 1.437 . . . . 0.31 111.95 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.72 -49.96 19.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.24 110.504 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -60.42 -38.12 83.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.091 -1.006 . . . . 1.59 109.391 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 22.5 ttt -57.42 -28.61 63.43 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.477 -0.765 . . . . 2.1 110.183 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.56 HG22 ' O ' ' A' ' 38' ' ' ILE . 63.6 mt -85.18 -2.81 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.829 -0.544 . . . . 0.49 111.047 -179.328 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.572 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 3.4 ptmt -64.16 -29.54 3.99 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 120.111 -1.618 . . . . 0.8 112.979 -178.592 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.0 Cg_exo -56.62 -41.67 73.4 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 121.525 1.581 . . . . 0.28 113.116 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.536 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 31.3 m-85 -68.15 -44.7 75.43 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.249 -1.532 . . . . 0.37 108.575 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -61.14 -53.9 51.19 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.79 0.805 . . . . 0.16 110.342 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -68.24 -42.27 79.97 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.77 -0.582 . . . . 0.32 111.404 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.4 m -60.52 -37.76 82.2 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.102 -0.999 . . . . 0.22 110.692 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 mt -63.15 -21.74 66.4 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.84 -1.163 . . . . 0.22 110.792 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.0 m -51.56 -39.43 57.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.613 -1.304 . . . . 0.16 108.916 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -82.46 -16.5 48.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.434 -0.791 . . . . 2.16 109.598 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -78.28 -36.68 46.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.091 -1.448 . . . . 1.78 107.091 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -124.18 67.85 1.06 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 107.353 -1.351 . . . . 0.25 107.353 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -63.86 -10.44 20.6 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.574 -0.899 . . . . 0.22 108.574 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -89.25 6.16 41.55 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.349 -0.982 . . . . 1.13 108.349 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.488 HG13 ' HB3' ' A' ' 22' ' ' LEU . 43.4 t -126.07 143.67 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 N-CA-C 107.289 -1.374 . . . . 0.24 107.289 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.6 mm -99.89 120.35 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 121.043 -1.036 . . . . 0.15 110.0 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.41 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.0 m-85 -100.83 128.64 46.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.157 -0.965 . . . . 0.12 109.496 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.41 HD12 ' C ' ' A' ' 54' ' ' PHE . 2.8 mp -110.34 140.01 44.97 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 120.945 -1.097 . . . . 0.22 109.771 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -110.1 132.01 54.54 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.777 -1.564 . . . . 1.13 106.777 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -130.13 130.19 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.06 -1.025 . . . . 0.15 110.437 -178.213 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 47.6 t0 -93.0 121.07 33.96 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.27 -1.011 . . . . 1.05 108.27 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -68.37 -19.0 23.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.689 -1.257 . . . . 0.16 108.362 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.2 m-20 -92.66 -39.83 11.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.45 -0.781 . . . . 1.08 112.126 -179.183 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -98.02 -14.39 20.57 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.708 -1.245 . . . . 1.07 108.199 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -126.83 39.32 3.94 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 107.586 -1.264 . . . . 0.14 107.586 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -59.79 -23.18 63.07 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 115.748 -0.66 . . . . 1.47 110.097 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.616 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -64.36 -39.99 94.97 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.94 -1.1 . . . . 1.05 109.177 179.619 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.616 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -69.54 -45.13 78.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 O-C-N 121.125 -0.985 . . . . 0.35 110.108 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.35 69.75 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.623 -0.673 . . . . 0.26 110.699 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.3 p -60.31 -39.43 86.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.936 -1.103 . . . . 0.24 109.981 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -62.88 -37.08 85.48 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.148 -0.97 . . . . 2.06 109.336 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.404 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.64 0.49 50.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.149 -0.97 . . . . 0.23 110.248 -179.618 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 52.28 50.25 18.79 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.868 -1.145 . . . . 2.02 109.375 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 35.3 t -64.17 134.57 28.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 120.46 -1.4 . . . . 0.16 108.138 -179.007 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -106.51 -12.38 15.63 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.501 -0.749 . . . . 1.6 109.987 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.523 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -161.49 155.02 21.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.96 -1.088 . . . . 0.14 110.378 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.62 155.72 80.8 Favored Pre-proline 0 N--CA 1.506 2.361 0 N-CA-C 107.596 -1.261 . . . . 0.15 107.596 178.539 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -73.03 142.87 76.08 Favored 'Cis proline' 0 N--CA 1.495 1.615 0 CA-C-N 120.22 1.114 . . . . 0.16 112.759 -2.321 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 89.8 m -130.1 129.97 44.24 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.511 -0.922 . . . . 0.13 108.511 178.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.563 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.8 m-85 -106.94 130.32 54.62 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.2 109.741 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.404 HE22 ' HB1' ' A' ' 69' ' ' ALA . 71.7 mt-30 -122.07 139.88 53.19 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.162 -0.961 . . . . 0.29 109.256 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -105.82 137.76 43.15 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.496 0.665 . . . . 0.14 110.448 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.82 150.27 52.06 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.82 -0.807 . . . . 0.15 108.82 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -147.16 129.37 15.64 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.562 -1.273 . . . . 1.68 107.562 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.7 mttt 52.0 32.26 9.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.836 -1.165 . . . . 1.22 109.04 -178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.83 21.65 76.15 Favored Glycine 0 N--CA 1.483 1.811 0 N-CA-C 110.452 -1.059 . . . . 0.23 110.452 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -127.87 142.48 51.26 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.298 -1.119 . . . . 2.07 110.26 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -76.84 127.34 32.56 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.46 -0.775 . . . . 1.82 109.456 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -121.35 1.56 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.562 -0.711 . . . . 0.3 110.442 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.92 163.69 31.02 Favored Glycine 0 N--CA 1.5 2.903 0 C-N-CA 118.701 -1.714 . . . . 0.17 111.57 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.486 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.4 tp10 -166.7 149.97 6.88 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.53 -0.983 . . . . 1.93 109.178 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.486 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.6 p90 -168.76 157.72 8.56 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.084 -1.01 . . . . 0.14 109.794 177.338 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -126.76 164.51 21.18 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.602 -0.687 . . . . 0.12 109.736 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.47 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 116.37 145.26 8.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.849 -1.301 . . . . 0.12 109.849 179.225 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.433 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -78.77 68.04 4.65 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.552 -0.97 . . . . 0.18 109.524 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -119.15 91.69 3.62 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 108.334 -0.988 . . . . 0.88 108.334 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.536 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -67.27 -30.98 71.01 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.636 -0.665 . . . . 1.06 111.55 -178.841 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.2 mp0 -67.42 -30.12 69.78 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.809 -1.182 . . . . 1.61 109.144 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.35 -35.26 75.25 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.268 -0.895 . . . . 1.45 108.762 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.1 mt -59.56 -38.96 82.5 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.904 0.859 . . . . 0.19 108.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -62.83 -43.38 98.94 Favored 'General case' 0 C--N 1.294 -1.816 0 C-N-CA 119.997 -0.681 . . . . 2.1 111.043 -178.127 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -43.8 70.7 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.114 -0.991 . . . . 0.19 112.032 -178.248 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -63.18 -39.5 94.83 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.943 -1.098 . . . . 0.2 109.996 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.417 ' O ' ' N ' ' A' ' 105' ' ' VAL . 49.4 mt -62.89 -49.19 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 120.984 -1.073 . . . . 0.16 108.391 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.443 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.5 t-20 -59.86 -36.62 77.25 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.84 -1.17 . . . . 0.95 107.84 179.002 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -67.17 -39.54 86.47 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.62 -0.675 . . . . 2.21 109.718 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.588 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.4 mt -100.82 0.57 38.91 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.839 -1.163 . . . . 0.25 111.683 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 102' ' ' ASN . 7.9 p . . . . . 0 N--CA 1.497 1.892 0 O-C-N 120.191 -1.568 . . . . 1.08 109.395 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.669 0.271 . . . . 1.31 110.331 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.523 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 31.2 mm -130.51 142.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 N-CA-C 109.728 -0.471 . . . . 0.15 109.728 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.4 m -97.69 129.55 44.74 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.635 -1.617 . . . . 0.19 106.635 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -79.53 139.86 37.42 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.894 -1.129 . . . . 0.2 111.307 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.433 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.0 m95 -74.42 -11.51 60.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.674 -0.641 . . . . 0.21 109.273 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 30.7 m-20 . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.399 -0.813 . . . . 0.49 109.033 179.479 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 tptt . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 108.546 -0.909 . . . . 1.67 108.546 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -96.45 124.01 40.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.201 -0.937 . . . . 0.31 108.653 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.2 mm -100.73 113.78 37.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 N-CA-C 108.364 -0.976 . . . . 0.19 108.364 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.74 -3.7 32.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.278 -0.889 . . . . 2.25 109.321 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -152.49 155.9 38.37 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.22 -0.925 . . . . 0.15 110.612 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -64.59 -31.84 73.23 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.349 -0.982 . . . . 1.65 108.349 178.642 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.7 m -55.64 -47.87 75.91 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.416 -0.913 . . . . 0.23 109.018 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.08 -30.24 69.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.427 -0.796 . . . . 0.17 109.177 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.512 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.6 t80 -59.69 -45.23 92.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.189 -0.944 . . . . 0.14 109.237 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -63.87 -41.41 97.76 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 108.89 -0.781 . . . . 1.31 108.89 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.98 -37.21 86.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.677 -0.639 . . . . 1.77 110.006 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.45 80.32 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.369 -0.832 . . . . 0.15 109.42 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.512 HD11 ' CE2' ' A' ' 11' ' ' PHE . 85.1 mt -60.21 -40.12 88.99 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.444 -0.947 . . . . 0.17 108.444 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.83 -34.77 74.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.625 -0.672 . . . . 1.07 109.925 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.7 85.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.283 -0.886 . . . . 0.18 109.91 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.47 -31.87 71.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.246 -0.909 . . . . 0.17 109.999 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.49 18.38 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.687 -1.365 . . . . 0.2 109.687 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -91.77 2.52 56.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -1.102 . . . . 1.07 110.374 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -76.02 149.16 37.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.98 -1.075 . . . . 1.5 109.593 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.666 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.84 159.57 8.81 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.487 -1.301 . . . . 0.47 107.487 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.666 ' H ' HD23 ' A' ' 22' ' ' LEU . 96.1 t -146.9 109.94 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 O-C-N 120.823 -1.173 . . . . 0.17 108.82 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.7 t -98.27 142.27 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 N-CA-C 107.971 -1.122 . . . . 0.14 107.971 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.96 121.0 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.455 -0.778 . . . . 0.13 109.488 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.552 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.9 t70 -98.67 119.74 37.92 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.395 -0.816 . . . . 1.05 110.404 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -96.18 21.67 8.61 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.456 -0.777 . . . . 0.73 109.743 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -57.29 145.01 33.47 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.978 -1.076 . . . . 0.3 109.945 -178.476 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.562 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.9 127.43 33.5 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.678 -1.23 . . . . 0.22 107.678 179.155 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -68.59 -31.7 71.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.827 -1.149 . . . . 0.3 108.822 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.562 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.6 p-90 -73.22 -20.81 60.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.066 -1.021 . . . . 0.26 110.838 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 21.6 t -81.88 122.64 28.0 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.834 -1.166 . . . . 0.26 108.54 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.491 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.42 -54.04 34.86 Favored Glycine 0 N--CA 1.489 2.175 0 C-N-CA 120.748 -0.739 . . . . 0.23 111.822 -178.439 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.2 Cg_endo -60.56 -30.0 89.71 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 CA-C-N 119.398 1.599 . . . . 0.31 112.533 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -77.39 -54.19 6.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.072 -1.017 . . . . 0.24 109.695 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -61.35 -38.15 85.91 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.305 -0.872 . . . . 1.59 109.673 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.44 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 35.5 ttm -59.88 -28.17 67.31 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.46 -0.775 . . . . 2.1 109.529 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 38' ' ' ILE . 66.4 mt -80.94 -4.41 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.847 -0.533 . . . . 0.49 110.735 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.546 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.2 ptmt -64.36 -26.07 1.79 Allowed Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 120.364 -1.46 . . . . 0.8 113.174 -178.081 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.546 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.5 Cg_exo -57.42 -40.29 82.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 122.468 1.917 . . . . 0.28 112.663 -177.1 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -67.9 -46.16 72.38 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 118.204 -1.398 . . . . 0.37 108.196 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -60.18 -53.9 52.23 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.125 -0.985 . . . . 0.16 109.884 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.0 t60 -68.09 -40.17 82.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.595 -0.691 . . . . 0.32 111.391 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.51 -39.16 92.62 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.855 -1.153 . . . . 0.22 110.643 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.86 -21.91 65.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.183 -0.948 . . . . 0.22 110.368 -178.554 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.3 m -53.51 -34.95 59.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.854 -1.154 . . . . 0.16 108.478 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 44.8 mp0 -88.75 -14.9 36.05 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.486 -0.759 . . . . 2.16 109.123 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.13 -37.79 37.71 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.708 -1.219 . . . . 1.78 107.708 178.874 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -123.13 68.87 0.99 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 106.861 -1.533 . . . . 0.25 106.861 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.8 p -63.38 -8.53 9.13 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.932 -0.766 . . . . 0.22 108.932 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -90.98 8.94 32.74 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.275 -0.891 . . . . 1.13 108.62 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.448 HG13 ' HB3' ' A' ' 22' ' ' LEU . 42.8 t -127.29 144.97 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.685 -1.228 . . . . 0.24 107.685 178.849 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -99.82 123.65 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.009 -1.057 . . . . 0.15 109.473 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.546 ' C ' HD12 ' A' ' 55' ' ' LEU . 44.3 m-85 -104.81 125.25 50.67 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.424 -0.798 . . . . 0.12 109.7 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.546 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.7 mp -110.0 142.7 41.03 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.121 -0.987 . . . . 0.22 109.196 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -109.95 131.7 54.82 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.908 -1.516 . . . . 1.13 106.908 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.0 t -128.28 137.76 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.325 -0.859 . . . . 0.15 110.6 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.0 t0 -100.17 119.0 37.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 1.05 108.905 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -67.96 -17.54 22.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 120.394 -1.441 . . . . 0.16 108.149 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.513 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.3 m-20 -90.01 -42.72 10.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 1.08 111.458 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -97.66 -22.15 16.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.651 -1.28 . . . . 1.07 109.276 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -115.96 38.39 3.35 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.146 -1.427 . . . . 0.14 107.146 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.55 ' CD ' ' H ' ' A' ' 63' ' ' GLN . 0.0 OUTLIER -60.34 -20.49 59.54 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.814 -0.63 . . . . 1.47 109.65 -179.121 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.624 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -63.76 -37.92 89.19 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.959 -1.088 . . . . 1.05 108.933 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.624 HG23 ' OD1' ' A' ' 64' ' ' ASP . 14.8 t -74.38 -43.55 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.327 -0.858 . . . . 0.35 109.532 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.26 -39.64 78.31 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.491 -0.755 . . . . 0.26 111.005 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.9 p -62.64 -35.68 80.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.915 -1.116 . . . . 0.24 109.166 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.6 -38.45 91.16 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.489 -0.757 . . . . 2.06 109.569 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.72 -0.19 56.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.282 -0.886 . . . . 0.23 111.285 -178.76 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 54.87 50.31 15.91 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.866 -1.146 . . . . 2.02 110.42 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.9 t -65.66 132.24 31.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 120.941 -1.1 . . . . 0.16 109.114 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -103.83 -11.94 17.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.601 -0.687 . . . . 1.6 110.693 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.504 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -163.9 155.27 16.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.81 -1.181 . . . . 0.14 110.348 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -126.74 155.92 74.41 Favored Pre-proline 0 N--CA 1.498 1.959 0 N-CA-C 107.6 -1.259 . . . . 0.15 107.6 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -75.99 143.91 78.14 Favored 'Cis proline' 0 N--CA 1.487 1.098 0 C-N-CA 123.681 -1.383 . . . . 0.16 112.541 -1.709 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.82 133.79 48.13 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.517 -0.92 . . . . 0.13 108.517 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.552 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -113.33 131.47 55.95 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.538 -0.912 . . . . 0.2 108.538 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -122.54 141.62 51.48 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.273 -0.892 . . . . 0.29 108.684 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -107.8 132.64 53.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.697 -0.627 . . . . 0.14 110.582 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -125.28 147.39 49.13 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.368 0.604 . . . . 0.15 109.499 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -148.36 124.33 10.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.305 -0.872 . . . . 1.68 109.025 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.8 mttm 59.63 29.08 18.63 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.715 -1.217 . . . . 1.22 107.715 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.24 20.58 77.1 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.593 -1.403 . . . . 0.23 109.593 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -124.21 137.02 54.57 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.483 -1.01 . . . . 2.07 110.965 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.64 125.42 29.34 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.1 -1.0 . . . . 1.82 108.851 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 m -124.62 13.89 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.724 -0.61 . . . . 0.3 110.703 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.45 157.55 18.63 Favored Glycine 0 N--CA 1.499 2.88 0 C-N-CA 118.969 -1.586 . . . . 0.17 111.066 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.482 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.92 148.44 7.33 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.553 -0.906 . . . . 1.93 108.553 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.482 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 3.5 p90 -168.23 157.59 9.43 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.241 -0.912 . . . . 0.14 109.749 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -126.52 159.88 32.16 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.529 -0.732 . . . . 0.12 110.041 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.46 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.95 143.7 6.62 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.805 -1.318 . . . . 0.12 109.805 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.499 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.91 64.76 3.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.19 -1.182 . . . . 0.18 109.81 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -117.42 94.25 4.48 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.015 -1.106 . . . . 0.88 108.015 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -31.44 71.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.04 -1.037 . . . . 1.06 111.129 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -65.3 -29.77 70.56 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.905 -1.122 . . . . 1.61 109.351 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -60.42 -34.31 73.78 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.916 -0.772 . . . . 1.45 108.916 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.67 -38.81 82.5 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.051 0.929 . . . . 0.19 108.74 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.2 -43.72 98.2 Favored 'General case' 0 C--N 1.292 -1.918 0 C-N-CA 119.785 -0.766 . . . . 2.1 110.909 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.78 -44.0 74.56 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 0.19 111.861 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.4 m -64.79 -40.06 94.62 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.741 -1.224 . . . . 0.2 109.64 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.6 mt -60.79 -49.58 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.339 -0.986 . . . . 0.16 108.339 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.483 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.6 t-20 -60.35 -35.18 75.08 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.99 0.9 . . . . 0.95 108.581 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.81 -39.58 87.75 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.864 -0.523 . . . . 2.21 109.6 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.662 ' HB2' HD11 ' A' ' 22' ' ' LEU . 82.5 mt -99.63 -2.86 34.47 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.197 -0.94 . . . . 0.25 111.631 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.483 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.496 1.842 0 O-C-N 120.545 -1.347 . . . . 1.08 109.515 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 108.815 -0.809 . . . . 1.31 108.815 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.504 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 28.5 mm -131.5 140.0 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 O-C-N 121.864 -0.522 . . . . 0.15 109.732 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.0 m -96.4 128.44 43.33 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.156 -1.424 . . . . 0.19 107.156 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 55.2 m -77.61 141.6 39.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.723 -1.235 . . . . 0.2 110.751 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.453 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.7 m95 -76.94 -11.83 59.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.439 -0.788 . . . . 0.21 108.912 178.89 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 35.6 m-20 . . . . . 0 C--N 1.304 -1.398 0 N-CA-C 108.586 -0.894 . . . . 0.49 108.586 179.514 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.0 tptt . . . . . 0 N--CA 1.499 1.983 0 N-CA-C 108.874 -0.787 . . . . 1.67 108.874 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -97.86 121.88 40.31 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.235 -1.024 . . . . 0.31 108.235 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.0 mm -99.99 112.89 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.19 108.743 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.04 -0.03 47.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 2.25 109.903 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -153.53 156.39 37.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.707 -1.246 . . . . 0.15 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -65.06 -33.0 74.99 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.318 -0.993 . . . . 1.65 108.318 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 90.0 m -56.14 -48.05 76.99 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.871 -0.788 . . . . 0.23 108.871 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.67 -29.69 66.08 Favored 'General case' 0 C--N 1.295 -1.763 0 O-C-N 121.545 -0.722 . . . . 0.17 109.089 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.9 t80 -59.66 -44.09 93.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.188 -0.945 . . . . 0.14 109.164 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.92 -43.93 86.65 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.834 -0.802 . . . . 1.31 108.834 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -63.59 -36.31 83.38 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.465 0.65 . . . . 1.77 110.068 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.97 -43.84 78.08 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.349 -0.845 . . . . 0.15 109.439 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.535 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.6 mt -60.88 -40.14 91.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.441 -0.787 . . . . 0.17 109.321 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -69.48 -32.61 71.61 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.426 -0.796 . . . . 1.07 110.448 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.68 83.04 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.18 109.355 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.82 -36.11 80.18 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.511 -0.743 . . . . 0.17 109.625 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.48 -123.27 16.29 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.976 -1.249 . . . . 0.2 109.976 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -91.15 3.75 53.98 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.195 -1.18 . . . . 1.07 110.224 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -77.14 149.18 35.65 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.994 -1.066 . . . . 1.5 109.768 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.694 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.3 153.72 21.88 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.834 -1.173 . . . . 0.47 107.834 -179.798 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.694 ' H ' HD23 ' A' ' 22' ' ' LEU . 57.3 t -143.97 120.73 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 N-CA-C 107.995 -1.113 . . . . 0.17 107.995 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -108.03 140.08 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.456 -0.942 . . . . 0.14 108.456 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -123.25 119.9 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.327 -0.858 . . . . 0.13 109.462 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.568 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 25.6 t70 -97.37 108.96 21.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.496 -0.753 . . . . 1.05 110.8 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.98 103.03 15.73 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.268 -1.753 . . . . 0.73 106.268 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.4 m -130.07 150.05 51.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.016 -0.735 . . . . 0.3 109.016 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.625 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.61 120.97 29.46 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.455 -1.313 . . . . 0.22 107.455 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -65.73 -32.21 73.63 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 118.541 -1.264 . . . . 0.3 108.039 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.625 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.3 p-90 -70.73 -23.77 62.51 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.32 -0.863 . . . . 0.26 111.063 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -84.43 115.13 22.38 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.827 -1.171 . . . . 0.26 108.751 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.454 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.72 -50.75 64.3 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 120.819 -0.705 . . . . 0.23 111.787 -178.272 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.2 Cg_exo -51.97 -36.18 63.55 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 CA-C-N 118.826 1.313 . . . . 0.31 112.866 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.5 -47.83 21.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.128 -0.982 . . . . 0.24 109.623 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.28 -35.68 76.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 1.59 109.097 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.54 ' SD ' ' O ' ' A' ' 37' ' ' MET . 11.6 tmm? -59.64 -29.36 67.98 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.516 -0.74 . . . . 2.1 110.06 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.539 HG22 ' O ' ' A' ' 38' ' ' ILE . 71.0 mt -82.71 -1.32 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.539 -0.726 . . . . 0.49 110.822 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.538 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.96 -30.12 6.43 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 120.535 -1.353 . . . . 0.8 113.976 -178.832 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.38 -40.6 66.08 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 CA-C-N 121.618 1.614 . . . . 0.28 113.266 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -68.8 -49.66 56.73 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 118.365 -1.334 . . . . 0.37 109.303 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.33 -51.08 71.06 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 121.761 0.791 . . . . 0.16 109.34 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.7 t60 -66.73 -40.96 88.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.621 -0.674 . . . . 0.32 110.724 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.422 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 72.3 m -63.39 -39.02 93.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.903 -1.123 . . . . 0.22 110.498 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.34 -23.08 66.57 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 0.22 111.366 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.4 m -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.788 -1.195 . . . . 0.16 108.364 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -88.94 -15.56 33.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.273 -0.892 . . . . 2.16 109.355 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HD3' ' CE2' ' A' ' 49' ' ' TYR . 13.2 tmtt? -79.26 -33.81 43.17 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.151 -1.425 . . . . 1.78 107.151 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.411 ' CE2' ' HD3' ' A' ' 48' ' ' LYS . 71.3 m-85 -122.16 64.43 0.93 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 106.776 -1.564 . . . . 0.25 106.776 177.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.5 p -61.86 -9.29 6.4 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.74 -0.837 . . . . 0.22 108.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -91.1 8.63 34.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.506 -0.746 . . . . 1.13 109.207 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.0 t -128.24 152.72 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 N-CA-C 108.225 -1.028 . . . . 0.24 108.225 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -102.73 122.12 54.69 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.148 -0.97 . . . . 0.15 110.132 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.589 ' C ' HD12 ' A' ' 55' ' ' LEU . 54.0 m-85 -105.49 130.05 53.65 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.238 -0.914 . . . . 0.12 109.868 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.589 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.4 mp -114.29 143.14 45.36 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.307 -0.871 . . . . 0.22 109.495 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -113.66 131.08 56.28 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 106.954 -1.499 . . . . 1.13 106.954 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.4 t -128.43 136.46 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 O-C-N 121.215 -0.928 . . . . 0.15 111.344 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.4 t0 -99.49 120.01 38.94 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.932 -0.766 . . . . 1.05 108.932 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.7 m -68.25 -16.7 21.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 O-C-N 120.523 -1.361 . . . . 0.16 108.471 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.6 m-20 -94.47 -40.76 9.72 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.426 -0.796 . . . . 1.08 111.448 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.5 m-20 -96.84 -16.79 20.59 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.796 -1.19 . . . . 1.07 108.62 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.61 40.67 3.67 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.489 -1.3 . . . . 0.14 107.489 179.0 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.09 -20.31 57.51 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.879 -0.513 . . . . 1.47 110.206 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.644 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.7 p30 -65.56 -38.65 90.17 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.683 -1.26 . . . . 1.05 109.176 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.644 HG23 ' OD1' ' A' ' 64' ' ' ASP . 20.1 t -72.76 -42.57 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.199 -0.938 . . . . 0.35 109.459 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.71 -41.95 71.25 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.484 -0.76 . . . . 0.26 110.999 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.7 p -60.14 -36.08 76.72 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.869 -1.144 . . . . 0.24 108.533 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -64.41 -39.28 93.54 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.475 -0.766 . . . . 2.06 109.492 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.56 0.45 54.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.25 -0.906 . . . . 0.23 111.019 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 54.14 50.07 17.33 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.917 -1.115 . . . . 2.02 110.059 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -65.58 131.69 31.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.787 -1.196 . . . . 0.16 109.043 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -103.71 -14.36 16.13 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.717 -0.614 . . . . 1.6 109.937 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.461 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.6 152.33 15.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.938 -1.101 . . . . 0.14 110.769 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.407 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.4 p -127.49 154.4 77.44 Favored Pre-proline 0 N--CA 1.503 2.176 0 N-CA-C 107.736 -1.209 . . . . 0.15 107.736 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -76.22 141.19 69.57 Favored 'Cis proline' 0 N--CA 1.495 1.59 0 C-N-CA 124.147 -1.189 . . . . 0.16 112.991 -1.889 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.2 m -126.72 139.2 53.32 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.498 -0.927 . . . . 0.13 108.498 177.845 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.568 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.8 m-85 -112.61 131.8 55.45 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.349 -0.982 . . . . 0.2 108.349 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.98 139.9 53.59 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.432 -0.951 . . . . 0.29 108.432 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -107.68 129.6 55.0 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.542 0.687 . . . . 0.14 110.034 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -122.58 143.27 49.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.753 -0.832 . . . . 0.15 108.753 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -146.28 130.61 17.61 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.426 -1.694 . . . . 1.68 106.426 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.2 mttt 58.17 27.75 15.52 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 108.449 -0.945 . . . . 1.22 108.449 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.3 17.26 80.1 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.893 -1.283 . . . . 0.23 109.893 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 39.4 mm-40 -123.33 138.48 54.6 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.449 -1.03 . . . . 2.07 111.107 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -79.58 124.44 28.53 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.352 -0.842 . . . . 1.82 109.347 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.2 m -121.53 6.81 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.529 -0.732 . . . . 0.3 110.648 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.34 155.56 15.31 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 118.666 -1.731 . . . . 0.17 111.321 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -164.25 149.89 10.61 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.812 -0.816 . . . . 1.93 109.546 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.407 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 17.8 p90 -163.01 161.81 25.65 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.92 -1.112 . . . . 0.14 109.151 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -127.0 162.38 26.14 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.485 0.66 . . . . 0.12 110.276 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.494 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 118.27 141.66 6.78 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.465 -1.454 . . . . 0.12 109.465 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.01 64.88 1.97 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.34 -1.094 . . . . 0.18 109.795 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -117.47 95.9 5.17 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.558 -0.904 . . . . 0.88 108.558 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -34.1 73.15 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.248 -0.908 . . . . 1.06 111.212 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.24 -30.1 70.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.806 -1.184 . . . . 1.61 108.783 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -61.98 -34.43 76.14 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.746 -0.596 . . . . 1.45 109.404 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.417 HD21 ' CD1' ' A' ' 77' ' ' PHE . 50.8 mt -59.87 -39.93 86.93 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.13 0.967 . . . . 0.19 108.888 179.477 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -61.65 -43.64 98.48 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.581 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.29 -44.09 76.25 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.282 -0.886 . . . . 0.19 111.629 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.4 -40.02 92.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.733 -1.229 . . . . 0.2 109.659 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.6 mt -60.94 -49.48 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.206 -1.035 . . . . 0.16 108.206 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.465 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.5 t-20 -60.12 -34.78 73.98 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.48 -0.933 . . . . 0.95 108.48 179.146 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -67.91 -40.05 83.48 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.688 -0.632 . . . . 2.21 110.325 -178.643 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.643 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.9 mt -98.77 -3.68 35.09 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.148 -0.97 . . . . 0.25 111.117 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.492 1.631 0 O-C-N 120.548 -1.345 . . . . 1.08 109.076 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 109.416 -0.587 . . . . 1.31 109.416 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.494 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.7 mm -129.17 140.07 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.622 -0.674 . . . . 0.15 109.967 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 63.3 m -96.75 124.35 40.71 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.163 -1.421 . . . . 0.19 107.163 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -77.61 141.57 39.41 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.845 -1.159 . . . . 0.2 110.908 -178.608 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.407 ' NE1' HG23 ' A' ' 74' ' ' THR . 20.2 m95 -76.56 -10.01 59.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.005 -1.059 . . . . 0.21 108.508 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 . . . . . 0 C--N 1.304 -1.383 0 N-CA-C 108.577 -0.897 . . . . 0.49 108.577 179.847 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.8 tptt . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 108.269 -1.011 . . . . 1.67 108.269 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -98.01 123.7 42.14 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.331 -0.989 . . . . 0.31 108.331 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.0 mm -101.56 112.79 35.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.186 -0.946 . . . . 0.19 108.508 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.444 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 50.4 mp0 -95.87 -1.26 49.78 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.313 -0.867 . . . . 2.25 109.392 -179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -153.98 154.8 34.41 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.947 -1.096 . . . . 0.15 111.439 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.9 ttpp -63.38 -31.16 72.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.98 -1.119 . . . . 1.65 107.98 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.8 m -59.05 -46.65 87.7 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.934 -0.765 . . . . 0.23 108.934 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 -30.02 66.4 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.288 -0.883 . . . . 0.17 108.692 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.58 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.6 t80 -59.45 -43.83 93.08 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.119 -0.988 . . . . 0.14 109.321 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -63.68 -41.98 98.09 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 119.634 -0.827 . . . . 1.31 108.796 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -64.94 -39.87 94.17 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.666 -0.646 . . . . 1.77 110.483 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -41.24 94.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.308 -0.87 . . . . 0.15 108.966 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.58 HD11 ' CE2' ' A' ' 11' ' ' PHE . 39.6 mt -61.23 -40.17 93.01 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.112 -0.993 . . . . 0.17 108.734 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.28 -34.55 72.91 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.965 -0.694 . . . . 1.07 109.698 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.03 80.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.362 -0.836 . . . . 0.18 110.298 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.23 70.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.069 -1.02 . . . . 0.17 109.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.81 -124.57 21.07 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.144 -1.582 . . . . 0.2 109.144 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -91.97 0.46 57.47 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -1.085 . . . . 1.07 110.336 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -75.72 149.89 37.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.996 -1.065 . . . . 1.5 109.345 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 22' ' ' LEU . 11.1 mt -55.81 160.58 2.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.019 -1.051 . . . . 0.47 110.213 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.1 t -148.62 108.35 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 107.995 -1.113 . . . . 0.17 107.995 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.3 t -100.95 140.8 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 107.606 -1.257 . . . . 0.14 107.606 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -124.63 124.5 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.186 -0.946 . . . . 0.13 109.748 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -101.09 116.96 34.05 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.431 -0.793 . . . . 1.05 110.022 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -91.95 22.53 4.22 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.73 110.265 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -54.52 144.42 21.38 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.666 -1.271 . . . . 0.3 110.667 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.693 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -80.99 127.97 33.17 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.084 -1.45 . . . . 0.22 107.084 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -67.94 -31.32 70.99 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.832 -1.147 . . . . 0.3 108.527 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.693 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 69.7 p-90 -76.53 -13.53 60.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.342 -0.849 . . . . 0.26 111.467 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.3 t -87.98 114.27 24.44 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.679 -1.263 . . . . 0.26 108.592 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.25 -51.94 54.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.647 -0.981 . . . . 0.23 110.647 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 32.9 Cg_exo -50.44 -38.04 52.65 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 CA-C-N 118.463 1.132 . . . . 0.31 112.183 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.99 -43.74 23.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.24 109.66 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -59.96 -32.13 70.53 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.986 -1.071 . . . . 1.59 108.819 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 54.5 ttm -60.41 -29.28 68.87 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 2.1 109.828 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.429 HD11 ' HB1' ' A' ' 92' ' ' ALA . 17.1 mt -80.29 -4.21 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.934 -0.479 . . . . 0.49 110.997 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.69 -30.93 7.11 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 119.823 -1.798 . . . . 0.8 113.724 -177.727 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.3 Cg_exo -59.5 -36.42 93.33 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 CA-C-N 121.586 1.602 . . . . 0.28 112.0 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -72.41 -51.63 19.52 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 118.686 -1.206 . . . . 0.37 108.874 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -59.61 -48.28 82.27 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.892 -0.781 . . . . 0.16 108.892 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -68.18 -42.46 79.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.298 -0.876 . . . . 0.32 110.812 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.3 m -64.52 -37.09 86.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.927 -1.108 . . . . 0.22 110.771 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.8 -22.78 66.87 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.125 -0.984 . . . . 0.22 110.525 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -53.57 -37.14 62.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.766 -1.209 . . . . 0.16 107.903 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -87.85 -15.34 37.05 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.556 -0.715 . . . . 2.16 109.501 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -76.69 -38.26 54.73 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.254 -1.387 . . . . 1.78 107.254 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -123.66 69.37 1.04 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.183 -1.414 . . . . 0.25 107.183 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.3 p -64.18 -8.98 14.17 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.012 -0.736 . . . . 0.22 109.012 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -89.07 8.54 29.3 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.621 -0.881 . . . . 1.13 108.621 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.36 146.46 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.059 -1.089 . . . . 0.24 108.059 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.1 mm -99.79 119.75 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 120.997 -1.064 . . . . 0.15 109.828 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.576 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.3 m-85 -101.15 127.85 47.52 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.273 -0.892 . . . . 0.12 109.98 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.7 mp -110.75 143.0 41.95 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.229 -0.919 . . . . 0.22 110.13 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -113.53 129.66 56.51 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 106.973 -1.492 . . . . 1.13 106.973 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.5 t -127.97 132.0 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.152 -0.968 . . . . 0.15 110.914 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 52.2 t0 -93.74 119.88 33.29 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.815 -0.809 . . . . 1.05 108.815 179.132 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.19 -17.33 22.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 120.672 -1.267 . . . . 0.16 107.797 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.503 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.18 -43.97 9.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 1.08 111.527 -178.924 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -94.41 -14.99 24.7 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.649 -1.282 . . . . 1.07 108.573 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.02 37.62 4.37 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.966 -1.124 . . . . 0.14 107.966 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.57 -18.14 38.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.8 -0.563 . . . . 1.47 110.668 -178.398 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 1.3 p30 -66.36 -43.08 87.02 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.838 -1.164 . . . . 1.05 108.719 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.2 t -68.72 -44.62 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.469 -0.769 . . . . 0.35 110.056 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.25 -39.08 75.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.426 -0.796 . . . . 0.26 110.663 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -62.62 -32.79 73.87 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.942 -1.099 . . . . 0.24 109.154 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.05 -39.86 95.02 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.494 -0.754 . . . . 2.06 109.617 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.33 2.03 51.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -0.932 . . . . 0.23 110.476 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 53.14 51.55 15.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.322 -0.861 . . . . 2.02 108.788 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.5 t -63.97 131.14 29.55 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 C-N-CA 118.517 -1.273 . . . . 0.16 108.391 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -103.77 -11.38 17.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.679 -0.638 . . . . 1.6 110.707 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.7 154.87 18.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.709 -1.245 . . . . 0.14 111.167 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.494 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.4 p -126.34 154.53 74.77 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.359 -0.978 . . . . 0.15 108.359 178.93 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.35 143.69 75.54 Favored 'Cis proline' 0 N--CA 1.494 1.518 0 C-N-CA 123.829 -1.321 . . . . 0.16 112.615 -2.867 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 86.0 m -129.66 131.19 46.32 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.556 0.693 . . . . 0.13 109.305 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -108.59 132.76 53.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.6 -0.687 . . . . 0.2 109.221 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -122.72 141.07 52.18 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.506 -0.924 . . . . 0.29 108.506 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -108.51 133.9 52.03 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.741 -0.599 . . . . 0.14 110.167 -179.2 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -124.56 147.26 48.54 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.502 0.668 . . . . 0.15 109.837 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -144.99 128.58 17.1 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.87 -1.159 . . . . 1.68 107.87 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 49.69 38.78 16.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.116 -0.99 . . . . 1.22 108.335 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.73 24.29 76.38 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.796 -1.192 . . . . 0.23 110.169 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -128.37 135.12 49.11 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.333 -1.098 . . . . 2.07 110.339 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -79.46 127.38 32.05 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.035 -1.04 . . . . 1.82 109.312 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.9 m -124.19 5.59 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.71 -0.619 . . . . 0.3 110.692 -179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.82 154.22 13.89 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 118.465 -1.826 . . . . 0.17 111.476 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.7 tm-20 -164.88 149.71 9.39 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.788 -0.83 . . . . 1.93 109.305 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.439 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 15.1 p90 -163.18 160.97 24.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.192 -1.003 . . . . 0.14 109.524 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.73 159.99 30.9 Favored 'General case' 0 N--CA 1.5 2.053 0 CA-C-O 121.388 0.614 . . . . 0.12 109.71 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.463 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.88 142.14 6.09 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 108.933 -1.667 . . . . 0.12 108.933 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.429 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.09 66.01 4.42 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.217 -1.167 . . . . 0.18 109.94 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.6 t-20 -119.64 99.89 6.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.351 -0.843 . . . . 0.88 109.306 178.647 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.413 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.47 -33.51 74.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.341 -0.849 . . . . 1.06 111.672 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.22 -27.13 67.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.438 -1.414 . . . . 1.61 109.376 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 22.5 ttmt -61.13 -37.75 83.93 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.144 -1.058 . . . . 1.45 108.144 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.5 mt -58.63 -39.6 80.99 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 122.056 0.931 . . . . 0.19 108.5 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -61.53 -43.22 99.25 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.21 -0.596 . . . . 2.1 111.005 -178.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.53 -43.99 71.9 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.094 -1.004 . . . . 0.19 112.08 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.99 -39.23 93.16 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.798 -1.189 . . . . 0.2 110.172 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.98 -49.57 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.097 -1.002 . . . . 0.16 108.377 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.8 t-20 -60.91 -35.76 77.52 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.589 -0.893 . . . . 0.95 108.589 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.5 tm-20 -68.25 -39.1 82.35 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.695 -0.628 . . . . 2.21 110.166 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.91 -6.5 28.77 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.002 -1.061 . . . . 0.25 111.534 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' ' 105' ' ' VAL . 7.9 p . . . . . 0 N--CA 1.501 2.101 0 O-C-N 120.441 -1.412 . . . . 1.08 109.657 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 108.765 -0.828 . . . . 1.31 108.765 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.463 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.4 mm -130.07 140.32 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.794 -0.566 . . . . 0.15 109.571 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -99.83 129.83 45.97 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 106.759 -1.571 . . . . 0.19 106.759 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.1 m -81.46 138.4 35.52 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.535 -1.353 . . . . 0.2 111.321 -178.354 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.494 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.2 m95 -72.11 -9.79 58.9 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.064 -1.022 . . . . 0.21 109.572 178.845 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 . . . . . 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.49 109.272 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 80.2 tttt . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 108.885 -0.783 . . . . 1.67 108.885 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -94.3 124.12 38.12 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.359 -0.978 . . . . 0.31 108.359 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -100.16 112.85 33.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 108.478 -0.934 . . . . 0.19 108.478 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.454 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -97.39 -0.26 46.61 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.063 -1.023 . . . . 2.25 109.652 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -155.16 159.15 39.94 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.993 -1.067 . . . . 0.15 111.216 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -63.5 -32.34 73.76 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.073 -1.084 . . . . 1.65 108.073 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.432 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 88.1 m -57.76 -48.35 79.9 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.665 -0.814 . . . . 0.23 108.813 -179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -30.86 69.45 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.259 -0.901 . . . . 0.17 108.715 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.1 t80 -59.33 -43.87 92.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.149 -0.969 . . . . 0.14 109.06 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -66.35 -42.99 87.27 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 120.046 -0.662 . . . . 1.31 109.449 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -65.12 -39.94 93.79 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.69 -0.631 . . . . 1.77 110.328 179.629 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.73 88.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.081 -1.012 . . . . 0.15 109.446 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.539 HD11 ' CE2' ' A' ' 11' ' ' PHE . 63.8 mt -60.71 -39.94 90.42 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.162 -1.051 . . . . 0.17 108.162 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -69.84 -36.96 75.99 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.674 -0.641 . . . . 1.07 110.205 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.76 -37.48 82.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.51 -0.744 . . . . 0.18 109.926 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.07 72.93 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.871 . . . . 0.17 109.649 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -125.87 24.67 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 110.015 -1.234 . . . . 0.2 110.015 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -92.02 5.9 48.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.107 -1.231 . . . . 1.07 110.203 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -76.39 149.36 36.93 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.838 -1.164 . . . . 1.5 109.472 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.676 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.05 155.53 16.78 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.523 -1.288 . . . . 0.47 107.523 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.655 ' H ' HD23 ' A' ' 22' ' ' LEU . 64.7 t -143.22 111.54 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 O-C-N 120.919 -1.113 . . . . 0.17 109.059 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.0 t -100.65 141.88 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 107.91 -1.145 . . . . 0.14 107.91 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.06 124.31 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.341 -0.85 . . . . 0.13 109.443 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.5 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.637 -0.664 . . . . 1.05 110.144 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -95.91 23.17 6.58 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.348 -0.845 . . . . 0.73 109.95 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.415 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.5 m -59.02 145.25 42.58 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.844 -1.16 . . . . 0.3 110.385 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.582 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.05 126.81 33.42 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.547 -1.279 . . . . 0.22 107.547 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -68.27 -28.31 67.09 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 118.848 -1.141 . . . . 0.3 108.781 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.582 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.8 p-90 -77.42 -19.22 56.4 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.079 -1.013 . . . . 0.26 110.072 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 34.2 t -83.84 122.45 28.71 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.167 -1.049 . . . . 0.26 108.167 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.49 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.6 -54.08 34.11 Favored Glycine 0 N--CA 1.488 2.113 0 C-N-CA 120.728 -0.749 . . . . 0.23 111.977 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.3 Cg_endo -59.53 -31.04 93.93 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 CA-C-N 119.588 1.694 . . . . 0.31 112.404 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -76.69 -55.48 5.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.036 -1.04 . . . . 0.24 109.805 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -60.16 -38.43 83.15 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.942 -1.099 . . . . 1.59 110.25 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.33 -28.79 67.14 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.088 -1.008 . . . . 2.1 109.677 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.8 mt -83.36 -3.86 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.751 -0.593 . . . . 0.49 111.312 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.4 ptmt -66.67 -29.83 3.0 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 120.262 -1.524 . . . . 0.8 113.468 -177.372 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -54.74 -39.83 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.759 1.664 . . . . 0.28 112.409 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.434 ' CD2' ' HG3' ' A' ' 94' ' ' LYS . 32.4 m-85 -68.74 -44.05 74.61 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 118.187 -1.405 . . . . 0.37 108.134 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -60.34 -54.18 48.77 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.33 -0.856 . . . . 0.16 109.533 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.3 t60 -66.98 -39.92 87.29 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.82 -0.55 . . . . 0.32 110.554 -179.593 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 75.7 m -61.47 -37.79 84.91 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.87 -1.144 . . . . 0.22 110.286 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.3 mt -60.99 -23.6 65.49 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.334 -0.854 . . . . 0.22 110.298 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -54.79 -38.94 67.91 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.069 -1.02 . . . . 0.16 108.915 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.8 mp0 -87.87 -13.51 41.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 2.16 109.733 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -80.34 -37.49 32.42 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 105.76 -1.941 . . . . 1.78 105.76 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -123.1 66.75 0.98 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.199 -1.408 . . . . 0.25 107.199 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.3 p -62.33 -8.32 5.73 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.952 -0.759 . . . . 0.22 108.952 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -91.03 9.72 29.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.737 -0.838 . . . . 1.13 108.737 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.469 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.5 t -129.3 147.01 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 N-CA-C 108.169 -1.048 . . . . 0.24 108.169 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.8 120.1 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 120.961 -1.087 . . . . 0.15 110.165 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.477 ' C ' HD12 ' A' ' 55' ' ' LEU . 29.3 m-85 -102.28 127.84 49.08 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.985 -1.072 . . . . 0.12 109.348 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.477 HD12 ' C ' ' A' ' 54' ' ' PHE . 1.9 mp -110.02 140.3 44.19 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.245 -0.909 . . . . 0.22 109.389 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -110.4 129.52 55.74 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.69 -1.596 . . . . 1.13 106.69 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.67 129.87 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 121.555 0.693 . . . . 0.15 110.252 -178.188 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 55.7 t0 -93.24 119.58 32.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.333 -0.988 . . . . 1.05 108.333 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -67.29 -20.46 26.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 C-N-CA 118.301 -1.36 . . . . 0.16 108.186 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.541 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.39 -42.12 10.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.433 -0.792 . . . . 1.08 111.696 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.441 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 22.0 m-20 -96.18 -13.86 23.2 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.688 -1.257 . . . . 1.07 108.412 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -126.06 40.05 3.81 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.703 -1.221 . . . . 0.14 107.703 179.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -59.86 -24.81 64.53 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.841 -0.537 . . . . 1.47 109.969 -178.618 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.608 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -65.52 -39.36 91.71 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.79 -1.194 . . . . 1.05 109.497 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.608 HG23 ' OD1' ' A' ' 64' ' ' ASP . 15.2 t -69.92 -44.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.133 -0.979 . . . . 0.35 109.669 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -36.52 66.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.681 -0.637 . . . . 0.26 110.847 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.8 p -60.55 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.24 109.573 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.3 -37.08 85.85 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.292 -0.88 . . . . 2.06 109.537 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.459 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.13 -0.15 53.59 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 0.23 111.04 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.2 mp0 54.38 49.41 18.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.984 -1.073 . . . . 2.02 109.845 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.85 134.35 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 120.833 -1.167 . . . . 0.16 108.763 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -106.43 -12.48 15.63 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.527 -0.733 . . . . 1.6 110.474 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.487 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -161.26 153.37 19.86 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.836 -1.165 . . . . 0.14 110.562 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -125.2 155.65 70.88 Favored Pre-proline 0 N--CA 1.499 2.016 0 N-CA-C 107.861 -1.163 . . . . 0.15 107.861 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -76.35 145.09 81.22 Favored 'Cis proline' 0 N--CA 1.491 1.341 0 C-N-CA 123.724 -1.365 . . . . 0.16 112.514 -2.459 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.7 m -129.45 132.2 46.91 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 108.735 -0.839 . . . . 0.13 108.735 178.443 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.729 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.0 m-85 -110.16 130.76 55.49 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 109.109 -0.7 . . . . 0.2 109.109 -179.191 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.459 HE22 ' HB1' ' A' ' 69' ' ' ALA . 72.2 mt-30 -122.82 139.34 54.12 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.739 -0.838 . . . . 0.29 108.739 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -106.83 132.06 53.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.356 0.598 . . . . 0.14 110.197 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -125.94 147.75 49.42 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.181 -0.674 . . . . 0.15 109.181 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -147.18 125.54 12.32 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.483 -1.303 . . . . 1.68 107.483 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.1 mttt 59.58 28.22 17.58 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.195 -1.409 . . . . 1.22 107.195 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.34 16.24 80.86 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.996 -1.242 . . . . 0.23 109.996 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -115.57 132.94 56.47 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.472 -1.016 . . . . 2.07 110.467 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -77.14 124.22 27.5 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 107.896 -1.15 . . . . 1.82 107.896 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.8 m -123.52 11.88 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.696 -0.627 . . . . 0.3 110.06 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.23 156.03 15.08 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 118.909 -1.615 . . . . 0.17 111.251 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -166.4 148.0 6.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.886 -0.773 . . . . 1.93 109.223 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.573 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 7.1 p90 -164.47 159.04 18.99 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 119.828 -0.749 . . . . 0.14 109.523 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.67 161.39 28.19 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.558 0.694 . . . . 0.12 110.022 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.439 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.98 142.1 5.93 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.519 -1.433 . . . . 0.12 109.519 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.566 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.26 65.06 2.78 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -1.094 . . . . 0.18 109.721 -179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -120.04 90.82 3.4 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.398 -0.964 . . . . 0.88 108.398 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.492 ' H ' ' CD ' ' A' ' 94' ' ' LYS . 0.2 OUTLIER -64.47 -35.13 79.95 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.068 -1.02 . . . . 1.06 111.546 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -62.04 -30.06 70.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.798 -1.189 . . . . 1.61 109.969 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.573 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 58.3 tttm -61.46 -32.91 72.91 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.669 0.747 . . . . 1.45 109.314 -179.183 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.729 HD21 ' CD1' ' A' ' 77' ' ' PHE . 47.0 mt -59.62 -39.68 85.04 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.215 -1.031 . . . . 0.19 108.215 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.47 -41.36 97.12 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 120.073 -0.651 . . . . 2.1 110.547 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.82 -43.45 75.54 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.087 -1.008 . . . . 0.19 111.698 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.8 m -67.3 -36.09 80.81 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.757 -1.214 . . . . 0.2 109.949 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.7 -50.11 79.34 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.061 -1.024 . . . . 0.16 108.35 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.476 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.3 t30 -60.03 -34.47 73.42 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.256 -1.016 . . . . 0.95 108.256 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.07 -39.97 82.82 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.752 -0.592 . . . . 2.21 110.406 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.676 ' HB2' HD11 ' A' ' 22' ' ' LEU . 94.8 mt -98.95 -2.99 36.07 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.218 -0.926 . . . . 0.25 111.293 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.2 p . . . . . 0 N--CA 1.496 1.87 0 O-C-N 120.413 -1.43 . . . . 1.08 109.11 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 109.674 -0.491 . . . . 1.31 109.674 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.487 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 32.7 mm -129.02 140.11 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 N-CA-C 109.259 -0.645 . . . . 0.15 109.259 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.0 m -98.29 131.55 44.52 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 107.272 -1.381 . . . . 0.19 107.272 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -81.46 140.12 34.8 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.614 -1.304 . . . . 0.2 111.29 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.417 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.1 m95 -74.22 -10.1 59.27 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.203 -0.936 . . . . 0.21 109.697 179.021 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.008 -1.057 . . . . 0.49 108.76 179.249 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.9 tptt . . . . . 0 N--CA 1.499 2.013 0 N-CA-C 108.122 -1.066 . . . . 1.67 108.122 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -97.13 123.24 40.84 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.339 -0.986 . . . . 0.31 108.339 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.0 mm -100.3 112.8 34.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.774 -0.824 . . . . 0.19 108.774 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.4 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -94.63 -2.01 52.15 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 120.916 -1.115 . . . . 2.25 110.203 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -152.21 154.08 35.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.659 -1.275 . . . . 0.15 110.801 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -63.45 -32.42 73.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.258 -1.016 . . . . 1.65 108.258 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.6 m -57.89 -46.73 84.48 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.285 -0.966 . . . . 0.23 108.651 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.12 -29.53 67.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.412 -0.805 . . . . 0.17 108.992 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.401 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.6 t80 -59.85 -44.09 94.31 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.479 -0.934 . . . . 0.14 108.479 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.32 -43.64 94.03 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.016 -0.735 . . . . 1.31 109.016 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -64.29 -35.8 82.03 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.376 0.608 . . . . 1.77 109.819 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.04 -41.67 81.7 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.271 -0.893 . . . . 0.15 109.045 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.6 mt -61.0 -41.22 96.09 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.104 -1.038 . . . . 0.17 108.668 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -69.5 -39.28 77.68 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.399 -0.813 . . . . 1.07 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.36 80.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.257 -0.902 . . . . 0.18 110.405 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.82 -28.62 69.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.162 -0.961 . . . . 0.17 110.257 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.02 -130.7 30.33 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.045 -1.222 . . . . 0.2 110.045 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -89.97 2.47 55.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.124 -1.221 . . . . 1.07 110.698 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -76.73 150.44 36.26 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.902 -1.124 . . . . 1.5 109.474 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' A' ' 22' ' ' LEU . 12.2 mt -57.97 158.64 6.42 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.106 -0.996 . . . . 0.47 111.011 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.1 t -147.06 108.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.432 -0.951 . . . . 0.17 108.432 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.401 HG22 ' CD2' ' A' ' 79' ' ' PHE . 58.7 t -101.48 143.53 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.227 -1.397 . . . . 0.14 107.227 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -125.18 123.24 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.319 -0.863 . . . . 0.13 110.139 -178.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.522 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.16 123.57 42.28 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.006 -0.738 . . . . 1.05 109.006 179.105 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.72 24.34 8.46 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.997 -1.065 . . . . 0.73 109.601 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.424 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 46.8 m -58.47 147.9 30.14 Favored 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.09 -1.006 . . . . 0.3 110.498 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.6 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.44 127.29 34.34 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 107.422 -1.325 . . . . 0.22 107.422 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.2 t -66.93 -30.92 71.19 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.695 -1.202 . . . . 0.3 108.949 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.6 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 64.0 p-90 -76.61 -16.48 59.56 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.09 -1.006 . . . . 0.26 111.565 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -86.38 114.0 22.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.616 -1.302 . . . . 0.26 108.408 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.45 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -59.98 -51.37 59.3 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 120.317 -0.944 . . . . 0.23 111.232 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 32.8 Cg_exo -50.44 -37.6 51.71 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 CA-C-N 118.96 1.38 . . . . 0.31 112.396 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.424 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.85 -44.17 28.08 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.272 -0.893 . . . . 0.24 109.331 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -59.85 -32.02 70.29 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.534 -0.913 . . . . 1.59 108.534 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.8 ttt -60.14 -29.3 68.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.582 -0.699 . . . . 2.1 109.797 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.492 HD11 ' HB1' ' A' ' 92' ' ' ALA . 8.6 mt -83.01 -4.65 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.512 -0.743 . . . . 0.49 110.833 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.535 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.18 -32.45 10.83 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 119.701 -1.874 . . . . 0.8 113.131 -176.986 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.7 Cg_exo -58.82 -36.53 96.86 Favored 'Trans proline' 0 N--CA 1.493 1.446 0 CA-C-N 121.675 1.634 . . . . 0.28 112.046 -178.226 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.41 -51.88 18.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.822 -1.174 . . . . 0.37 109.007 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.37 -46.85 87.5 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.155 0.979 . . . . 0.16 108.744 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -68.07 -46.88 69.82 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 115.918 -0.583 . . . . 0.32 110.866 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 72.8 m -60.88 -38.87 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.091 -1.005 . . . . 0.22 110.343 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.32 -24.52 66.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.263 -0.898 . . . . 0.22 111.07 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.4 m -54.1 -37.75 64.62 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.659 -1.275 . . . . 0.16 108.109 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -85.44 -18.22 34.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.917 -1.114 . . . . 2.16 109.789 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -74.84 -37.03 62.35 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.052 -1.462 . . . . 1.78 107.052 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -122.99 68.07 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 107.243 -1.391 . . . . 0.25 107.243 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.6 p -64.7 -8.71 15.7 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.97 -0.752 . . . . 0.22 108.97 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -91.66 6.72 44.72 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 1.13 108.385 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.4 t -126.02 146.02 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 107.73 -1.211 . . . . 0.24 107.73 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.2 mm -99.1 124.88 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.132 -0.98 . . . . 0.15 109.73 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.53 ' C ' HD12 ' A' ' 55' ' ' LEU . 47.1 m-85 -107.09 127.74 53.75 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.288 -0.882 . . . . 0.12 109.529 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.53 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -110.93 140.21 45.62 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.047 -1.033 . . . . 0.22 110.056 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -109.77 129.89 55.57 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.52 -1.659 . . . . 1.13 106.52 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.6 t -125.37 135.09 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.193 -0.942 . . . . 0.15 110.109 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 52.5 t0 -98.19 117.44 32.57 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.745 -0.835 . . . . 1.05 108.745 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.5 m -65.01 -19.47 25.72 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 120.526 -1.359 . . . . 0.16 108.19 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.19 -41.19 11.13 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 1.08 111.949 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -97.49 -18.36 19.06 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.611 -1.306 . . . . 1.07 108.826 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -120.31 39.1 3.8 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 107.925 -1.139 . . . . 0.14 107.925 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -60.06 -19.56 53.59 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.745 -0.597 . . . . 1.47 109.702 -178.742 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.594 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -63.55 -35.76 81.54 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.894 -1.129 . . . . 1.05 109.066 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.594 HG23 ' OD1' ' A' ' 64' ' ' ASP . 13.2 t -73.4 -41.31 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.067 -1.021 . . . . 0.35 108.951 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.69 -41.91 78.52 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.64 -0.663 . . . . 0.26 110.638 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.0 p -60.01 -39.14 84.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.842 -1.161 . . . . 0.24 108.847 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -65.79 -40.06 91.59 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.352 -0.842 . . . . 2.06 109.465 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.61 -3.9 58.96 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.203 -0.935 . . . . 0.23 111.388 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 53.35 49.67 19.21 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.834 -1.166 . . . . 2.02 110.476 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.08 132.83 32.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 O-C-N 120.602 -1.311 . . . . 0.16 108.52 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -103.68 -12.16 17.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.396 -0.815 . . . . 1.6 110.67 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.508 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -158.4 155.36 28.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.709 -1.245 . . . . 0.14 110.905 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.44 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.9 p -129.8 154.58 81.06 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 108.007 -1.108 . . . . 0.15 108.007 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -77.04 141.92 70.8 Favored 'Cis proline' 0 N--CA 1.49 1.309 0 C-N-CA 123.666 -1.389 . . . . 0.16 112.462 -2.755 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.8 m -125.95 136.13 52.65 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.659 -0.867 . . . . 0.13 108.659 178.411 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.764 ' CD1' HD21 ' A' ' 97' ' ' LEU . 88.9 m-85 -111.75 132.95 54.31 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.505 -0.924 . . . . 0.2 108.505 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -123.83 143.23 50.46 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.661 -0.866 . . . . 0.29 108.661 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.401 ' CD2' HG22 ' A' ' 24' ' ' VAL . 59.4 m-85 -108.65 129.74 55.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.468 0.651 . . . . 0.14 110.722 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -124.15 142.26 51.37 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.86 -0.793 . . . . 0.15 108.86 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -146.44 127.05 14.2 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.531 -1.285 . . . . 1.68 107.531 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.8 mttt 60.07 28.88 18.48 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.433 -0.792 . . . . 1.22 109.282 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.94 14.42 82.02 Favored Glycine 0 N--CA 1.495 2.63 0 O-C-N 120.857 -1.152 . . . . 0.23 110.664 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -124.11 144.3 49.96 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.335 -1.097 . . . . 2.07 110.877 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -81.92 126.71 32.23 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.593 -0.692 . . . . 1.82 109.16 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.67 9.58 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.617 -0.677 . . . . 0.3 110.707 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.23 162.56 28.69 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 118.239 -1.934 . . . . 0.17 111.471 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -168.42 148.05 4.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.97 -0.752 . . . . 1.93 108.97 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.485 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 4.1 p90 -167.78 156.01 9.07 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.197 -0.94 . . . . 0.14 109.664 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.9 p -126.34 160.0 31.61 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.563 -0.71 . . . . 0.12 109.997 -179.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.44 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.14 141.51 5.78 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.471 -1.452 . . . . 0.12 109.471 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.492 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.16 65.41 2.13 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.288 -1.125 . . . . 0.18 110.056 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -119.52 97.71 5.78 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.642 -0.873 . . . . 0.88 108.642 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -32.47 71.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.069 -1.019 . . . . 1.06 111.732 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -64.25 -30.05 71.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.082 -1.011 . . . . 1.61 109.321 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -60.42 -35.47 75.86 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.301 -0.629 . . . . 1.45 109.301 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.764 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.0 mt -59.79 -39.87 86.41 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.145 0.974 . . . . 0.19 108.797 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -63.24 -40.43 97.41 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.967 -0.693 . . . . 2.1 110.755 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -44.3 72.45 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.078 -1.013 . . . . 0.19 111.754 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.0 m -67.11 -38.55 85.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.771 -1.205 . . . . 0.2 109.819 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.7 mt -60.91 -49.93 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.187 -0.946 . . . . 0.16 108.494 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.01 -36.38 77.08 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 122.055 0.931 . . . . 0.95 109.074 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -67.2 -40.16 86.45 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.732 -0.605 . . . . 2.21 110.38 -178.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.3 mt -99.36 -4.7 31.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.12 -0.988 . . . . 0.25 111.225 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.497 1.901 0 O-C-N 120.207 -1.558 . . . . 1.08 109.366 -178.71 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.458 -0.571 . . . . 1.31 109.458 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.44 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.8 mm -128.9 141.57 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.896 -0.503 . . . . 0.15 110.169 -179.119 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.5 m -101.21 128.25 47.42 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.799 -1.556 . . . . 0.19 106.799 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.9 m -79.84 141.1 36.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.759 -1.213 . . . . 0.2 110.442 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.508 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.2 m95 -74.47 -12.23 60.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.217 -0.927 . . . . 0.21 109.316 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 44.9 m-20 . . . . . 0 N--CA 1.488 1.437 0 O-C-N 121.145 -0.972 . . . . 0.49 108.919 -179.982 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.3 tptt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 108.486 -0.931 . . . . 1.67 108.486 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.41 125.1 41.84 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.227 -0.921 . . . . 0.31 108.829 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.9 mm -103.03 113.6 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 108.382 -0.97 . . . . 0.19 108.382 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -96.88 -0.64 47.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.011 -1.056 . . . . 2.25 109.843 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -154.7 156.53 36.56 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.014 -1.054 . . . . 0.15 110.802 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -63.62 -31.95 73.27 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.289 -1.004 . . . . 1.65 108.289 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.451 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 59.3 m -57.15 -48.21 79.25 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.403 -0.919 . . . . 0.23 108.826 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.36 -28.82 66.54 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.205 -0.934 . . . . 0.17 108.959 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.476 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.0 t80 -59.9 -43.94 94.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.323 -0.861 . . . . 0.14 109.272 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -65.59 -42.55 91.57 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.823 -0.751 . . . . 1.31 109.052 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.55 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.67 -40.05 95.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 1.77 110.394 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.24 90.86 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.137 -0.977 . . . . 0.15 109.239 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.476 HD11 ' CE2' ' A' ' 11' ' ' PHE . 80.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.222 -1.029 . . . . 0.17 108.222 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -70.07 -35.31 74.13 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.926 -0.71 . . . . 1.07 110.127 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.05 -36.65 77.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.095 -1.003 . . . . 0.18 110.001 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.32 -34.76 77.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.918 -1.114 . . . . 0.17 109.507 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.37 -124.52 19.2 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 110.125 -1.19 . . . . 0.2 110.125 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -91.92 5.2 50.97 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.943 -1.328 . . . . 1.07 110.307 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -77.29 149.33 35.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.004 -1.06 . . . . 1.5 109.021 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.681 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -61.2 156.49 18.31 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.614 -1.254 . . . . 0.47 107.614 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.647 ' H ' HD23 ' A' ' 22' ' ' LEU . 84.5 t -143.78 113.04 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.807 -1.183 . . . . 0.17 109.205 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.3 t -101.22 142.39 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.392 -0.966 . . . . 0.14 108.392 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -125.42 121.96 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.218 -0.926 . . . . 0.13 109.582 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -98.82 120.9 40.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.355 -0.841 . . . . 1.05 110.346 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -95.94 24.43 5.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.73 109.49 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -59.22 145.79 41.53 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.154 -0.966 . . . . 0.3 110.545 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.654 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.21 123.3 31.33 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.406 -0.961 . . . . 0.22 108.406 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.91 -30.96 70.42 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.91 -1.144 . . . . 0.3 107.91 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.654 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 55.8 p-90 -71.38 -26.38 62.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.373 -0.829 . . . . 0.26 110.6 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.27 123.68 29.83 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.803 -1.186 . . . . 0.26 107.967 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.423 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.08 -53.07 32.06 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.506 -0.854 . . . . 0.23 111.534 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.4 Cg_exo -51.55 -31.96 41.9 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 CA-C-N 118.704 1.252 . . . . 0.31 112.095 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.38 -50.67 10.48 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.377 -0.827 . . . . 0.24 109.725 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.67 -39.27 83.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.282 -0.887 . . . . 1.59 109.468 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.3 ttm -57.6 -27.7 62.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.474 -0.766 . . . . 2.1 109.622 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.559 HG22 ' O ' ' A' ' 38' ' ' ILE . 66.3 mt -85.29 -2.99 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.49 111.374 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.35 -30.13 6.22 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 120.447 -1.408 . . . . 0.8 113.454 -179.289 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 33.8 Cg_exo -59.28 -41.62 57.47 Favored 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 121.52 1.578 . . . . 0.28 113.642 -176.91 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.98 -45.27 74.59 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 117.589 -1.644 . . . . 0.37 107.771 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -59.69 -54.37 47.14 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.202 -0.936 . . . . 0.16 110.239 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -68.24 -40.0 82.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.546 -0.721 . . . . 0.32 110.866 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.5 m -61.18 -39.03 88.61 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.823 -1.173 . . . . 0.22 110.755 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -61.93 -22.51 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.143 -0.973 . . . . 0.22 110.901 -178.723 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.9 m -54.12 -35.45 62.2 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 120.82 -1.175 . . . . 0.16 108.457 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -88.26 -14.78 37.55 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.485 -0.759 . . . . 2.16 108.961 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.34 -36.21 39.8 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 106.955 -1.498 . . . . 1.78 106.955 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.413 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 78.0 m-85 -124.82 68.83 1.1 Allowed 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.29 -1.374 . . . . 0.25 107.29 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 71.7 p -65.11 -8.5 16.97 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.496 -0.752 . . . . 0.22 109.188 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -89.02 6.09 41.34 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.456 HG13 ' HB3' ' A' ' 22' ' ' LEU . 41.6 t -126.09 145.56 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 107.441 -1.318 . . . . 0.24 107.441 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.0 122.24 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.159 0 O-C-N 121.164 -0.96 . . . . 0.15 109.456 -178.611 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.581 ' C ' HD12 ' A' ' 55' ' ' LEU . 38.1 m-85 -103.12 125.17 49.71 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.317 -0.864 . . . . 0.12 109.549 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.581 HD12 ' C ' ' A' ' 54' ' ' PHE . 6.0 mp -110.09 142.04 42.1 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -0.999 . . . . 0.22 109.585 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -109.41 132.33 54.23 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 106.897 -1.52 . . . . 1.13 106.897 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.2 t -130.28 134.17 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 121.231 -0.918 . . . . 0.15 110.856 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 40.8 t0 -96.35 120.85 37.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.564 -0.71 . . . . 1.05 109.44 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.4 m -67.81 -19.35 24.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.635 -1.29 . . . . 0.16 108.464 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.9 m-20 -92.24 -43.68 9.17 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.483 -0.761 . . . . 1.08 111.446 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.44 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 33.4 m-20 -93.25 -21.87 19.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.535 -1.353 . . . . 1.07 108.355 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -117.61 38.57 3.57 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 107.982 -1.118 . . . . 0.14 107.982 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -59.83 -22.19 61.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.814 -0.554 . . . . 1.47 109.903 -178.757 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.601 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -63.93 -38.86 92.63 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.123 -0.986 . . . . 1.05 108.943 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.601 HG23 ' OD1' ' A' ' 64' ' ' ASP . 12.0 t -72.48 -43.98 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 O-C-N 121.319 -0.863 . . . . 0.35 109.952 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -40.16 75.63 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.564 -0.71 . . . . 0.26 111.118 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -63.02 -32.69 74.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.909 -1.119 . . . . 0.24 108.884 -179.392 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -39.89 95.64 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.839 -0.8 . . . . 2.06 108.839 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.28 0.52 56.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.601 -0.687 . . . . 0.23 109.872 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 54.52 50.17 16.64 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.273 -0.892 . . . . 2.02 109.718 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.37 131.35 28.88 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 C-N-CA 118.153 -1.419 . . . . 0.16 108.732 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -104.86 -10.48 17.31 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.94 -0.475 . . . . 1.6 110.15 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.93 152.28 15.24 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.834 -1.166 . . . . 0.14 110.915 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -124.99 154.12 71.24 Favored Pre-proline 0 N--CA 1.5 2.07 0 N-CA-C 107.388 -1.338 . . . . 0.15 107.388 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -77.37 144.21 76.97 Favored 'Cis proline' 0 N--CA 1.487 1.107 0 C-N-CA 123.601 -1.416 . . . . 0.16 112.062 -2.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.3 m -129.96 133.87 47.08 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.199 -1.037 . . . . 0.13 108.199 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.425 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 84.1 m-85 -112.46 132.24 55.16 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.356 -0.979 . . . . 0.2 108.356 -179.339 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -123.15 142.79 50.51 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.285 -0.884 . . . . 0.29 108.976 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -108.17 132.12 53.95 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-O 121.712 0.768 . . . . 0.14 111.395 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -125.77 145.44 50.2 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.239 -0.652 . . . . 0.15 109.239 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -147.7 131.44 16.96 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.251 -1.389 . . . . 1.68 107.251 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 59.0 mttp 56.22 26.76 10.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.564 -1.273 . . . . 1.22 107.564 -177.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.07 17.46 79.68 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 110.354 -1.098 . . . . 0.23 110.354 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -117.93 136.71 53.31 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.47 -1.018 . . . . 2.07 109.869 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -79.41 122.21 26.13 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.119 -0.988 . . . . 1.82 108.457 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 19.0 m -122.82 11.88 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.595 -0.691 . . . . 0.3 111.304 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.26 155.46 15.99 Favored Glycine 0 N--CA 1.496 2.694 0 C-N-CA 118.589 -1.767 . . . . 0.17 111.254 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.512 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.54 148.18 7.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.809 -0.818 . . . . 1.93 109.478 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.512 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.8 p90 -167.05 159.03 12.77 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.353 -0.842 . . . . 0.14 110.05 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.5 p -127.08 161.41 28.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.647 -0.658 . . . . 0.12 109.486 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.508 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.77 141.71 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 108.995 -1.642 . . . . 0.12 108.995 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.511 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -80.16 67.12 5.87 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.391 -1.064 . . . . 0.18 110.078 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.1 t-20 -120.25 99.37 6.55 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.355 -0.98 . . . . 0.88 108.355 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.493 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -67.82 -32.25 72.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 1.06 111.726 -178.822 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -65.97 -28.07 68.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.594 -1.317 . . . . 1.61 109.643 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.46 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 21.6 ttmt -61.0 -35.26 76.37 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 108.779 -0.822 . . . . 1.45 108.779 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 75.1 mt -59.64 -38.83 82.44 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.101 0.953 . . . . 0.19 108.949 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 98' ' ' GLU . . . . . 0.413 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 9.6 tp10 -63.23 -43.52 97.83 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 120.109 -0.637 . . . . 2.1 111.53 -177.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.11 -43.64 77.98 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.988 -1.07 . . . . 0.19 111.613 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.08 -40.13 94.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.739 -1.226 . . . . 0.2 109.739 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.0 mt -60.05 -50.02 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.155 -1.054 . . . . 0.16 108.155 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.477 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.9 t-20 -59.7 -35.3 74.23 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 122.041 0.924 . . . . 0.95 108.588 178.811 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -67.89 -39.84 83.59 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.532 -0.73 . . . . 2.21 109.971 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.681 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.8 mt -99.99 -0.89 38.42 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.214 -0.929 . . . . 0.25 111.273 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.7 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 120.481 -1.387 . . . . 1.08 109.265 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.559 -0.534 . . . . 1.31 109.559 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.508 HD11 ' HA2' ' A' ' 91' ' ' GLY . 38.3 mm -128.77 141.05 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 N-CA-C 109.541 -0.54 . . . . 0.15 109.541 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 34.7 m -98.47 127.27 44.33 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.837 -1.542 . . . . 0.19 106.837 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -77.54 139.36 39.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.688 -1.258 . . . . 0.2 110.738 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.472 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 21.1 m95 -74.52 -10.9 60.01 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.122 -0.987 . . . . 0.21 109.253 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 40.3 m-20 . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.425 -0.797 . . . . 0.49 109.16 179.665 . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.1 tptt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 108.881 -0.785 . . . . 1.67 108.881 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -94.71 126.16 39.84 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.898 -1.519 . . . . 0.31 106.898 178.074 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.9 mm -100.19 115.62 41.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 121.341 -0.85 . . . . 0.19 108.743 -179.786 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -98.55 -1.61 40.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.284 -0.885 . . . . 2.25 110.091 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.52 157.45 39.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.024 -1.048 . . . . 0.15 111.273 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.536 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 27.8 ttpt -66.74 -31.72 72.55 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.729 -1.211 . . . . 1.65 107.729 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 23.8 m -56.31 -48.11 77.36 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.703 -0.851 . . . . 0.23 108.703 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.1 -32.33 68.91 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.935 -0.765 . . . . 0.17 108.935 178.791 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.547 ' CE2' HD11 ' A' ' 15' ' ' LEU . 53.8 t80 -57.02 -42.86 81.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.887 . . . . 0.14 108.802 -179.15 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.01 -42.21 89.98 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 109.024 -0.732 . . . . 1.31 109.024 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.04 -38.56 91.28 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.201 0.525 . . . . 1.77 110.913 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.48 -40.53 89.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.059 -1.026 . . . . 0.15 109.176 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.547 HD11 ' CE2' ' A' ' 11' ' ' PHE . 75.0 mt -60.89 -39.98 91.3 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.412 -0.805 . . . . 0.17 109.412 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -70.24 -34.66 73.11 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.458 -0.776 . . . . 1.07 110.164 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.2 78.0 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.18 110.088 -178.773 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.44 -32.41 71.34 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.279 -0.888 . . . . 0.17 109.299 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.06 -127.25 27.21 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.197 -1.561 . . . . 0.2 109.197 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -90.79 4.08 52.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.109 -1.23 . . . . 1.07 110.693 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.6 mttm -75.13 148.97 39.21 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.846 -1.159 . . . . 1.5 109.633 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.7 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.01 155.85 19.16 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.333 -1.358 . . . . 0.47 107.333 179.591 . . . . . . . . 3 3 . 1 . 021 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.7 ' H ' HD23 ' A' ' 22' ' ' LEU . 47.3 t -145.13 121.77 4.15 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 N-CA-C 107.826 -1.175 . . . . 0.17 107.826 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.2 t -110.29 141.07 26.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 108.062 -1.088 . . . . 0.14 108.062 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.8 t -122.51 121.38 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.337 -0.852 . . . . 0.13 109.199 -179.45 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.569 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.7 t70 -99.34 109.31 21.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.46 -0.775 . . . . 1.05 111.114 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -89.88 104.66 17.2 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.688 -1.597 . . . . 0.73 106.688 176.916 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.2 m -129.99 144.21 51.21 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.622 -0.881 . . . . 0.3 108.622 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.618 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.31 122.39 27.89 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.461 -1.311 . . . . 0.22 107.461 178.93 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -64.43 -33.13 75.15 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.209 -1.034 . . . . 0.3 108.209 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.618 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.0 p-90 -71.8 -27.25 62.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.414 -0.803 . . . . 0.26 110.541 179.283 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -82.69 115.82 21.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.981 -1.075 . . . . 0.26 108.549 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.457 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.42 -51.9 54.89 Favored Glycine 0 N--CA 1.484 1.876 0 C-N-CA 120.535 -0.841 . . . . 0.23 111.329 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -52.03 -35.48 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 CA-C-N 118.689 1.245 . . . . 0.31 112.734 -179.153 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.83 -54.83 6.31 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.149 -0.969 . . . . 0.24 110.187 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -61.19 -36.28 79.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.114 -0.991 . . . . 1.59 109.76 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 30.0 ttp -58.1 -27.39 63.65 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.26 -0.9 . . . . 2.1 109.041 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.551 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -87.52 -9.19 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 112.178 0.436 . . . . 0.49 112.178 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 30.1 pttt -68.2 -30.45 2.66 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 119.965 -1.709 . . . . 0.8 113.437 -177.545 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.6 Cg_exo -49.83 -37.55 45.63 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 CA-C-N 121.843 1.694 . . . . 0.28 112.826 -178.54 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -68.09 -42.88 79.67 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 117.359 -1.736 . . . . 0.37 106.857 178.35 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -61.13 -53.64 54.54 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.349 -0.844 . . . . 0.16 109.815 178.358 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -67.73 -40.4 84.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.32 110.78 -179.622 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.409 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 71.2 m -60.44 -39.92 89.24 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.117 -0.989 . . . . 0.22 111.442 -179.611 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.91 -20.2 65.67 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.093 -1.004 . . . . 0.22 110.88 -177.986 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.7 m -51.28 -39.86 57.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.851 -1.156 . . . . 0.16 109.211 -178.559 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -81.33 -17.44 49.16 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.246 -0.909 . . . . 2.16 109.588 179.484 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -76.87 -38.4 53.72 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.273 -1.38 . . . . 1.78 107.273 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -121.21 68.72 0.89 Allowed 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 106.298 -1.742 . . . . 0.25 106.298 177.672 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -63.11 -9.02 9.03 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.707 -0.849 . . . . 0.22 108.707 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -91.14 8.53 35.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.684 -0.635 . . . . 1.13 109.433 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 22' ' ' LEU . 49.4 t -126.86 147.02 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 107.849 -1.167 . . . . 0.24 107.849 179.284 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.2 mm -99.53 120.96 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 120.987 -1.071 . . . . 0.15 109.794 -178.422 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.561 ' C ' HD12 ' A' ' 55' ' ' LEU . 57.1 m-85 -102.9 123.89 47.38 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.38 -0.825 . . . . 0.12 109.728 179.714 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.561 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -111.73 142.06 44.55 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.038 -1.039 . . . . 0.22 110.225 178.633 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.34 133.04 53.64 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 107.498 -1.297 . . . . 1.13 107.498 177.868 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.8 t -128.99 139.05 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.312 -0.868 . . . . 0.15 111.604 -178.149 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.613 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.1 t0 -102.28 120.04 39.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.135 -0.691 . . . . 1.05 109.135 179.433 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -68.13 -18.65 23.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.797 -1.189 . . . . 0.16 108.471 178.823 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -92.37 -41.53 10.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.387 -0.821 . . . . 1.08 111.608 -178.736 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -95.93 -15.05 22.62 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.602 -1.311 . . . . 1.07 108.122 179.085 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.64 39.69 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.228 -1.397 . . . . 0.14 107.228 179.031 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -60.98 -20.1 61.95 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.307 0.575 . . . . 1.47 109.48 -178.748 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.536 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 5.0 p-10 -67.4 -39.95 85.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.261 -0.899 . . . . 1.05 109.653 179.505 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -73.13 -42.55 58.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.659 0.743 . . . . 0.35 109.655 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -39.97 72.62 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.491 -0.756 . . . . 0.26 110.431 -179.39 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.7 p -60.46 -35.77 76.67 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.096 -1.003 . . . . 0.24 108.766 -179.537 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -62.41 -39.88 94.7 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.509 -0.745 . . . . 2.06 109.393 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.06 -1.73 57.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 0.23 111.164 -178.878 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 54.85 50.02 16.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.078 -1.014 . . . . 2.02 109.391 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.3 t -66.79 131.54 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.881 -1.137 . . . . 0.16 109.188 -178.931 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -103.95 -10.77 17.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.626 -0.672 . . . . 1.6 110.23 -179.534 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.58 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -162.24 155.32 20.24 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.829 -1.169 . . . . 0.14 110.434 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -130.1 153.86 81.18 Favored Pre-proline 0 N--CA 1.501 2.077 0 N-CA-C 107.818 -1.178 . . . . 0.15 107.818 179.017 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -75.66 142.56 74.39 Favored 'Cis proline' 0 N--CA 1.496 1.624 0 C-N-CA 123.73 -1.363 . . . . 0.16 113.192 -2.273 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.443 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -125.71 132.25 52.42 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.147 -1.057 . . . . 0.13 108.147 177.602 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.569 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 89.0 m-85 -108.2 130.64 55.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.742 -0.836 . . . . 0.2 108.742 -179.261 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -122.38 141.25 51.77 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.135 -1.061 . . . . 0.29 108.135 179.438 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -108.66 132.41 53.94 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.559 0.695 . . . . 0.14 110.643 -178.818 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -125.95 146.01 50.04 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.497 0.665 . . . . 0.15 109.925 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -149.59 131.14 14.85 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 107.975 -1.12 . . . . 1.68 107.975 179.062 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 57.34 27.52 13.9 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.467 -0.938 . . . . 1.22 108.467 -178.905 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.96 21.47 76.22 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.887 -1.285 . . . . 0.23 109.887 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -127.79 142.68 51.24 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -1.091 . . . . 2.07 110.043 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.447 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 76.3 tttt -79.96 129.79 34.77 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.014 -1.054 . . . . 1.82 109.166 179.665 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.4 m -123.01 4.6 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.637 -0.665 . . . . 0.3 110.741 -179.166 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 173.84 161.03 23.25 Favored Glycine 0 N--CA 1.495 2.577 0 C-N-CA 118.218 -1.944 . . . . 0.17 111.844 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.447 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 58.2 tt0 -163.9 151.88 12.88 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.714 -0.874 . . . . 1.93 109.479 179.04 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.473 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 6.7 p90 -166.72 157.15 11.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.435 -0.791 . . . . 0.14 109.781 177.983 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -127.51 163.05 24.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.812 0.815 . . . . 0.12 110.753 -178.606 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.477 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.63 143.96 7.15 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.208 -1.557 . . . . 0.12 109.208 179.373 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.85 67.14 2.21 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.364 -1.08 . . . . 0.18 110.403 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -120.2 91.19 3.48 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 108.455 -0.943 . . . . 0.88 108.455 178.197 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.73 72.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.022 -1.048 . . . . 1.06 111.353 -179.162 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -65.29 -29.84 70.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.753 -1.217 . . . . 1.61 109.961 -179.703 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.473 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 56.1 tttm -60.32 -35.8 76.44 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.374 -0.829 . . . . 1.45 109.296 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' A' ' 77' ' ' PHE . 58.0 mt -58.09 -39.24 78.1 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.738 -0.838 . . . . 0.19 108.738 179.685 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -61.8 -43.67 98.39 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 119.883 -0.727 . . . . 2.1 110.964 -178.407 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.39 -43.23 77.76 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.011 -1.055 . . . . 0.19 111.357 -178.709 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -64.63 -39.55 93.89 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.824 -1.173 . . . . 0.2 110.158 -178.285 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.44 -48.38 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.126 -0.984 . . . . 0.16 108.428 179.168 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.452 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.6 t-20 -59.95 -37.05 78.41 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.104 0.954 . . . . 0.95 108.689 179.226 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -67.33 -38.81 85.51 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.79 -0.569 . . . . 2.21 110.088 -178.341 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.652 ' HB2' HD11 ' A' ' 22' ' ' LEU . 79.6 mt -100.07 -2.88 33.16 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.918 -1.114 . . . . 0.25 111.367 -179.269 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.3 p . . . . . 0 N--CA 1.496 1.845 0 O-C-N 120.48 -1.388 . . . . 1.08 109.347 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 109.332 -0.618 . . . . 1.31 109.332 . . . . . . . . . 0 0 . 1 . 021 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.58 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 30.7 mm -130.74 141.07 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 N-CA-C 109.497 -0.557 . . . . 0.15 109.497 -179.607 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 64.9 m -95.91 131.66 42.02 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.518 -1.289 . . . . 0.19 107.518 177.828 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -80.18 139.32 36.83 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.811 -1.18 . . . . 0.2 111.384 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.443 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.1 m95 -78.03 -9.46 59.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.061 -1.024 . . . . 0.21 108.813 178.937 . . . . . . . . 2 2 . 1 . 021 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 . . . . . 0 C--N 1.304 -1.377 0 O-C-N 121.136 -0.978 . . . . 0.49 108.525 -179.936 . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.1 tptp . . . . . 0 N--CA 1.495 1.775 0 N-CA-C 108.185 -1.042 . . . . 1.67 108.185 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -95.06 123.75 38.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.008 -1.058 . . . . 0.31 109.027 179.788 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.87 111.97 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.513 -0.921 . . . . 0.19 108.513 179.509 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -96.64 -0.2 48.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.168 -0.957 . . . . 2.25 110.212 -179.355 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.43 156.89 36.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.787 -1.196 . . . . 0.15 110.803 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.457 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 33.5 ttmt -64.04 -32.76 74.42 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.8 -1.185 . . . . 1.65 107.8 177.866 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.9 m -56.13 -48.34 76.43 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.425 -0.91 . . . . 0.23 108.963 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.55 -31.36 70.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.247 -0.908 . . . . 0.17 109.28 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.498 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.2 t80 -58.99 -44.66 91.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.14 109.549 -178.906 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -64.11 -40.99 97.4 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.202 -1.036 . . . . 1.31 108.202 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -65.15 -36.7 85.06 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.562 0.696 . . . . 1.77 110.344 179.401 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.79 -43.84 78.76 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.795 -0.817 . . . . 0.15 108.795 -179.092 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.498 HD11 ' CE2' ' A' ' 11' ' ' PHE . 89.6 mt -60.67 -39.5 88.65 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.376 -0.972 . . . . 0.17 108.376 178.914 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.01 -32.96 72.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.428 -0.795 . . . . 1.07 109.962 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.2 63.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.13 -0.981 . . . . 0.18 110.539 -179.211 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.52 -30.08 70.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.05 -1.031 . . . . 0.17 109.555 -179.682 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.9 -127.37 24.96 Favored Glycine 0 N--CA 1.487 2.089 0 N-CA-C 110.08 -1.208 . . . . 0.2 110.08 -179.895 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -92.78 4.24 54.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.362 -1.081 . . . . 1.07 110.44 -179.139 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -75.45 151.33 38.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.172 -0.955 . . . . 1.5 109.388 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.677 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -61.3 156.03 19.78 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 107.54 -1.282 . . . . 0.47 107.54 -179.732 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.634 ' H ' HD23 ' A' ' 22' ' ' LEU . 60.7 t -142.69 119.57 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.064 -1.023 . . . . 0.17 108.469 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -105.89 139.82 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 N-CA-C 107.72 -1.215 . . . . 0.14 107.72 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 32.9 t -123.58 120.3 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.151 -0.968 . . . . 0.13 109.295 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -98.53 118.51 35.39 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.375 -0.828 . . . . 1.05 110.079 179.632 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -94.63 24.83 4.34 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.09 -1.007 . . . . 0.73 109.803 179.16 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.408 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.8 m -60.16 147.69 38.86 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.01 -1.056 . . . . 0.3 110.618 -179.011 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.774 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.83 124.0 31.09 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.602 -1.259 . . . . 0.22 107.602 178.81 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.4 t -66.96 -29.2 68.99 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 108.098 -1.075 . . . . 0.3 108.098 179.694 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.774 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 63.9 p-90 -75.53 -19.09 59.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.521 -0.737 . . . . 0.26 110.435 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.424 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 7.0 t -87.29 111.7 21.31 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.668 -1.234 . . . . 0.26 107.668 179.971 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.71 -50.93 62.42 Favored Glycine 0 N--CA 1.486 1.992 0 C-N-CA 120.557 -0.83 . . . . 0.23 111.379 -178.13 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.78 -35.94 50.07 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 CA-C-N 118.964 1.382 . . . . 0.31 111.234 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.54 -45.11 22.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.378 -0.826 . . . . 0.24 109.826 179.222 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -59.95 -31.34 69.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.162 -0.961 . . . . 1.59 108.841 179.621 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.521 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.2 tmm? -60.37 -29.59 69.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.582 -0.699 . . . . 2.1 109.642 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.465 HD11 ' HB1' ' A' ' 92' ' ' ALA . 9.5 mt -81.12 -5.56 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.741 -0.6 . . . . 0.49 111.106 -179.434 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.42 -30.86 7.78 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 119.881 -1.762 . . . . 0.8 112.971 -176.787 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.0 Cg_exo -59.72 -38.46 80.87 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 CA-C-N 121.722 1.651 . . . . 0.28 112.29 -178.529 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -71.43 -50.82 28.01 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.412 -1.315 . . . . 0.37 108.759 179.449 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.7 -48.64 80.88 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.217 -0.927 . . . . 0.16 109.252 179.129 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -67.5 -44.74 77.75 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.681 -0.637 . . . . 0.32 110.969 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 63.4 m -62.13 -36.42 81.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.953 -1.092 . . . . 0.22 110.35 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 mt -60.13 -26.12 66.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.198 -0.939 . . . . 0.22 110.477 -178.631 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.5 m -53.45 -41.79 66.5 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.79 -1.194 . . . . 0.16 108.428 -179.495 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.415 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 39.9 mp0 -86.06 -16.86 36.79 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.299 -0.876 . . . . 2.16 110.049 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -78.03 -37.22 47.39 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 106.516 -1.661 . . . . 1.78 106.516 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -123.12 70.03 1.02 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.266 -1.383 . . . . 0.25 107.266 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.6 p -65.67 -7.83 17.42 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.835 -0.802 . . . . 0.22 108.835 -179.498 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -88.47 3.9 48.47 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.685 -0.857 . . . . 1.13 108.685 179.023 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.414 HG13 ' HB3' ' A' ' 22' ' ' LEU . 39.7 t -126.4 145.56 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.562 -1.273 . . . . 0.24 107.562 178.909 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mm -98.67 121.86 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.045 . . . . 0.15 109.574 -178.32 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.607 ' C ' HD12 ' A' ' 55' ' ' LEU . 39.9 m-85 -102.63 123.86 47.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.24 -0.912 . . . . 0.12 109.747 179.525 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.607 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -110.39 140.16 44.89 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.266 -0.896 . . . . 0.22 109.696 178.957 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -109.98 130.0 55.59 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 106.831 -1.544 . . . . 1.13 106.831 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.9 136.72 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 CA-C-O 121.51 0.671 . . . . 0.15 110.474 -178.232 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.637 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.8 t0 -98.92 121.69 41.2 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 1.05 109.729 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -68.31 -17.49 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 120.98 -1.075 . . . . 0.16 108.702 179.02 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.7 m-20 -94.48 -41.99 9.08 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.525 -0.735 . . . . 1.08 111.591 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -96.91 -13.86 22.16 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.644 -1.285 . . . . 1.07 108.476 179.506 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.63 37.88 4.31 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.052 -1.462 . . . . 0.14 107.052 179.6 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.28 -21.85 62.43 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.972 -0.751 . . . . 1.47 108.972 -178.961 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.457 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 2.6 p30 -64.86 -39.64 93.87 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.134 -0.979 . . . . 1.05 108.964 179.215 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.5 t -73.59 -44.13 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.394 -0.816 . . . . 0.35 109.781 -179.65 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.27 72.03 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.381 -0.824 . . . . 0.26 110.71 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.8 p -61.2 -32.86 72.62 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.998 -1.064 . . . . 0.24 109.091 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -64.65 -39.92 94.54 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.488 -0.757 . . . . 2.06 110.19 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.81 1.66 53.34 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.292 -0.88 . . . . 0.23 110.677 -178.647 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 55.79 49.64 15.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.02 109.58 -179.538 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.77 130.65 30.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 C-N-CA 118.468 -1.293 . . . . 0.16 108.373 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -104.53 -10.8 17.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.628 -0.67 . . . . 1.6 109.968 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.478 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -161.78 155.85 22.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.9 -1.125 . . . . 0.14 110.991 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.68 156.26 79.08 Favored Pre-proline 0 N--CA 1.498 1.974 0 N-CA-C 107.819 -1.178 . . . . 0.15 107.819 179.087 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -76.06 139.67 61.78 Favored 'Cis proline' 0 N--CA 1.497 1.681 0 C-N-CA 123.969 -1.263 . . . . 0.16 112.611 -2.489 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -124.43 135.63 53.41 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 108.772 -0.825 . . . . 0.13 108.772 178.391 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.697 ' CD1' HD21 ' A' ' 97' ' ' LEU . 90.1 m-85 -113.12 131.75 55.71 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 109.121 -0.696 . . . . 0.2 109.121 -179.572 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -122.09 140.09 52.93 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.139 -1.06 . . . . 0.29 108.139 178.985 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -107.65 133.41 52.12 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.775 -0.578 . . . . 0.14 110.198 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -126.23 148.65 49.43 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.013 -0.736 . . . . 0.15 109.013 179.136 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -148.58 126.82 12.17 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 107.644 -1.243 . . . . 1.68 107.644 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.1 mttp 57.63 25.23 11.42 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.704 -1.221 . . . . 1.22 107.704 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.5 16.88 77.03 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 110.096 -1.202 . . . . 0.23 110.096 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -116.23 135.67 53.7 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.482 -1.011 . . . . 2.07 109.964 -179.628 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.461 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 80.9 tttt -81.54 122.5 27.65 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.307 -0.997 . . . . 1.82 108.307 178.32 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.3 m -123.29 9.87 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.648 -0.658 . . . . 0.3 110.811 -179.266 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.56 151.67 9.72 Favored Glycine 0 N--CA 1.499 2.885 0 C-N-CA 118.184 -1.96 . . . . 0.17 112.201 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.461 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 67.9 tt0 -164.48 151.22 11.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.684 -0.892 . . . . 1.93 109.341 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 21.5 p90 -163.21 161.27 24.82 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.768 -0.827 . . . . 0.14 108.768 177.423 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -125.92 160.05 30.97 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.554 0.692 . . . . 0.12 110.059 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.5 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.76 141.97 5.8 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.851 -1.699 . . . . 0.12 108.851 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.73 65.28 4.85 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.101 -1.235 . . . . 0.18 109.818 -179.553 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.9 t-20 -119.46 100.21 7.15 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.142 -1.058 . . . . 0.88 108.142 178.538 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.443 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.09 -32.36 72.63 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.346 -0.846 . . . . 1.06 111.538 -179.026 . . . . . . . . 3 3 . 1 . 022 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.48 -29.55 70.22 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.968 -1.082 . . . . 1.61 109.812 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.502 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 78.2 tttt -60.18 -38.28 82.75 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.982 -0.748 . . . . 1.45 108.982 -179.153 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' CD1' ' A' ' 77' ' ' PHE . 44.1 mt -57.14 -39.43 75.17 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.993 0.902 . . . . 0.19 108.743 179.431 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -61.66 -41.99 98.29 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 120.074 -0.65 . . . . 2.1 110.632 -177.989 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.41 -44.09 75.78 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.261 -0.899 . . . . 0.19 111.227 -179.095 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.2 m -66.16 -40.01 90.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.899 -1.126 . . . . 0.2 109.903 -178.445 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -60.92 -49.73 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 107.987 -1.116 . . . . 0.16 107.987 178.883 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.5 t-20 -59.95 -35.35 74.76 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.853 0.835 . . . . 0.95 108.752 178.877 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -67.19 -39.99 86.46 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.715 -0.616 . . . . 2.21 110.019 -178.74 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.0 mt -100.25 -1.87 35.26 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.316 -0.865 . . . . 0.25 111.206 -178.979 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.4 p . . . . . 0 N--CA 1.498 1.974 0 O-C-N 120.554 -1.341 . . . . 1.08 109.269 -179.64 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.539 -0.541 . . . . 1.31 109.539 . . . . . . . . . 0 0 . 1 . 022 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.5 HD11 ' HA2' ' A' ' 91' ' ' GLY . 30.3 mm -131.72 141.86 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 121.672 -0.642 . . . . 0.15 109.527 -179.765 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -101.73 126.5 48.6 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 107.688 -1.227 . . . . 0.19 107.688 177.649 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -76.97 144.35 38.82 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.988 -1.07 . . . . 0.2 110.813 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.478 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.5 m95 -79.47 -17.04 55.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.334 -0.854 . . . . 0.21 109.44 179.409 . . . . . . . . 2 2 . 1 . 022 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 . . . . . 0 C--N 1.302 -1.477 0 N-CA-C 107.868 -1.16 . . . . 0.49 107.868 179.369 . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 18.4 tptp . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 107.787 -1.19 . . . . 1.67 107.787 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -96.13 121.97 38.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.16 -0.963 . . . . 0.31 108.882 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.2 mm -102.21 117.5 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 107.793 -1.188 . . . . 0.19 107.793 179.379 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.7 mp0 -99.38 -0.75 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.921 -1.112 . . . . 2.25 109.993 -178.879 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.83 158.11 38.91 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.973 -1.079 . . . . 0.15 110.942 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -63.1 -32.79 74.25 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.467 -0.938 . . . . 1.65 108.467 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.0 m -57.65 -47.89 81.0 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.114 -0.991 . . . . 0.23 108.811 -179.484 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.18 -31.15 70.49 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.253 -0.905 . . . . 0.17 108.694 178.551 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.427 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.0 t80 -59.4 -43.86 92.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.14 108.655 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -66.05 -41.81 90.33 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.912 -0.773 . . . . 1.31 108.912 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -65.52 -35.68 81.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 1.77 110.307 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.04 -41.35 77.78 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.13 -0.982 . . . . 0.15 109.268 -179.406 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.427 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.7 mt -61.09 -39.9 91.67 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.192 -0.943 . . . . 0.17 108.549 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.17 -35.39 76.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.651 -0.655 . . . . 1.07 109.999 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.54 -35.85 75.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.293 -0.88 . . . . 0.18 110.486 -179.142 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.63 75.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.082 -1.011 . . . . 0.17 109.867 -179.72 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.07 -126.11 22.75 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.882 -1.287 . . . . 0.2 109.882 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -90.96 3.48 54.53 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.035 -1.273 . . . . 1.07 110.269 -178.886 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mttt -75.4 150.43 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.858 -1.151 . . . . 1.5 109.111 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.685 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -60.76 159.07 11.58 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 107.244 -1.391 . . . . 0.47 107.244 179.573 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.677 ' H ' HD23 ' A' ' 22' ' ' LEU . 94.2 t -145.66 120.06 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.87 -1.144 . . . . 0.17 108.712 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.9 t -108.35 142.6 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 107.955 -1.128 . . . . 0.14 107.955 179.551 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.7 118.76 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.189 -0.944 . . . . 0.13 109.157 -179.273 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.555 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 31.8 t70 -97.33 120.31 37.45 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.36 -0.837 . . . . 1.05 109.852 179.082 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -96.7 24.06 6.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.237 -0.914 . . . . 0.73 110.024 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.8 m -57.48 141.94 45.87 Favored 'General case' 0 C--N 1.294 -1.812 0 O-C-N 121.233 -0.917 . . . . 0.3 110.55 -178.243 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.731 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -81.65 125.52 30.67 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.671 -1.233 . . . . 0.22 107.671 179.138 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.72 -33.34 74.7 Favored 'General case' 0 C--N 1.295 -1.796 0 C-N-CA 118.94 -1.104 . . . . 0.3 108.342 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.731 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.6 p-90 -70.48 -24.23 62.82 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.669 . . . . 0.26 110.902 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.93 123.11 29.62 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.565 -1.272 . . . . 0.26 107.565 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.462 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.58 -51.82 39.18 Favored Glycine 0 N--CA 1.489 2.179 0 C-N-CA 120.27 -0.967 . . . . 0.23 111.235 -178.087 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -53.44 -33.87 69.12 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 CA-C-N 118.524 1.162 . . . . 0.31 111.443 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.52 -53.98 7.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.471 -0.768 . . . . 0.24 110.166 -179.896 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -60.08 -36.94 78.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.061 -1.024 . . . . 1.59 109.76 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.498 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -60.15 -30.95 69.64 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.232 -0.917 . . . . 2.1 109.917 -179.11 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.587 HG22 ' O ' ' A' ' 38' ' ' ILE . 70.0 mt -81.38 -4.5 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.863 -0.523 . . . . 0.49 111.324 -179.335 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.1 ptmt -64.85 -28.79 3.05 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 120.558 -1.339 . . . . 0.8 113.567 -177.179 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.8 Cg_exo -55.62 -39.64 89.93 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 CA-C-N 121.952 1.733 . . . . 0.28 113.22 -176.316 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -68.14 -44.61 75.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.815 -1.554 . . . . 0.37 108.319 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.33 -54.82 41.06 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.409 -0.807 . . . . 0.16 110.405 178.815 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -67.65 -41.14 84.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.494 -0.754 . . . . 0.32 110.939 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 64.1 m -62.14 -36.48 81.93 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.0 -1.063 . . . . 0.22 110.91 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -63.87 -19.37 65.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.214 -0.929 . . . . 0.22 110.04 -178.847 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -53.05 -39.53 63.32 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.91 -1.144 . . . . 0.16 107.91 -179.533 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 35.5 mp0 -82.96 -16.41 47.43 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.375 -0.828 . . . . 2.16 109.397 179.154 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -76.91 -39.0 52.39 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.513 -1.292 . . . . 1.78 107.513 179.166 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -123.7 67.81 1.03 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.3 -1.37 . . . . 0.25 107.3 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.2 p -62.89 -9.08 8.42 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.876 -0.787 . . . . 0.22 108.876 -179.467 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -90.13 6.91 40.52 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.288 -1.004 . . . . 1.13 108.288 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.502 HG13 ' HB3' ' A' ' 22' ' ' LEU . 55.2 t -125.05 145.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.041 -1.096 . . . . 0.24 108.041 179.42 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.5 mm -99.96 122.83 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 120.956 -1.09 . . . . 0.15 109.476 -178.549 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.603 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.7 m-85 -102.95 126.95 50.33 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.12 109.992 179.731 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.603 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -111.32 139.98 46.27 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.128 -0.983 . . . . 0.22 109.717 178.861 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -110.2 130.11 55.6 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 107.086 -1.45 . . . . 1.13 107.086 178.124 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.2 t -127.76 136.25 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.401 -0.812 . . . . 0.15 110.533 -177.847 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.605 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.6 t0 -98.69 120.34 38.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.363 -0.836 . . . . 1.05 108.95 179.507 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -66.74 -18.25 23.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 120.479 -1.388 . . . . 0.16 108.209 179.36 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 18.8 m-20 -93.8 -44.0 8.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.279 -0.888 . . . . 1.08 111.545 -179.097 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.4 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 25.8 m-20 -93.95 -13.49 27.01 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.537 -1.352 . . . . 1.07 108.423 179.586 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -125.24 38.38 4.19 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.578 -1.267 . . . . 0.14 107.578 179.518 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -59.9 -23.85 63.82 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.854 -0.528 . . . . 1.47 109.882 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.612 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -66.49 -38.26 86.87 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.034 -1.041 . . . . 1.05 108.984 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.612 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.2 t -69.95 -43.96 78.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.308 -0.87 . . . . 0.35 109.573 179.868 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 -36.33 64.0 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.449 -0.782 . . . . 0.26 111.235 -178.595 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.2 p -60.12 -37.73 80.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.773 -1.204 . . . . 0.24 109.428 -179.41 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.25 -38.13 89.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 2.06 109.526 179.327 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.448 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.44 -3.63 58.91 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.448 -0.782 . . . . 0.23 110.313 -178.907 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mp0 54.74 49.61 17.6 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.373 -0.829 . . . . 2.02 109.232 -179.584 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.77 132.21 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 120.846 -1.159 . . . . 0.16 108.576 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -103.48 -11.92 17.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.582 -0.699 . . . . 1.6 110.813 -178.902 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.517 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.97 156.26 24.53 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.751 -1.218 . . . . 0.14 110.596 -179.442 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -128.5 153.36 79.31 Favored Pre-proline 0 N--CA 1.497 1.888 0 N-CA-C 107.455 -1.313 . . . . 0.15 107.455 178.139 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -76.85 140.47 65.27 Favored 'Cis proline' 0 N--CA 1.488 1.205 0 C-N-CA 123.617 -1.409 . . . . 0.16 112.405 -2.655 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.517 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.0 m -124.91 132.64 53.27 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.934 -1.136 . . . . 0.13 107.934 177.475 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.555 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.0 m-85 -111.13 132.02 54.63 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.444 -0.947 . . . . 0.2 108.444 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.448 HE22 ' HB1' ' A' ' 69' ' ' ALA . 83.4 mt-30 -122.23 143.12 49.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.275 -0.89 . . . . 0.29 108.612 179.463 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 100' ' ' THR . 88.2 m-85 -109.12 132.68 53.89 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.525 0.679 . . . . 0.14 110.581 -178.589 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -127.53 147.29 50.32 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.473 0.654 . . . . 0.15 109.341 179.194 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -148.9 126.35 11.6 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.74 -1.207 . . . . 1.68 107.74 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.3 mttp 59.86 28.42 17.91 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.518 -0.739 . . . . 1.22 109.072 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.89 19.95 71.72 Favored Glycine 0 N--CA 1.489 2.198 0 O-C-N 121.101 -0.999 . . . . 0.23 111.095 179.281 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -130.46 145.13 51.78 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.045 -1.268 . . . . 2.07 109.94 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -79.87 126.86 31.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.287 -0.883 . . . . 1.82 109.636 179.663 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.6 m -121.63 6.04 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.737 -0.602 . . . . 0.3 110.126 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.81 157.03 21.09 Favored Glycine 0 N--CA 1.494 2.51 0 C-N-CA 118.716 -1.707 . . . . 0.17 111.454 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.453 ' OE2' ' CG2' ' A' ' 76' ' ' THR . 2.3 tp10 -164.95 147.46 8.22 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.518 -0.919 . . . . 1.93 108.518 179.367 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.46 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 4.3 p90 -169.4 155.87 6.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.665 -0.814 . . . . 0.14 109.213 177.932 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.4 p -126.17 162.77 24.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.688 -0.633 . . . . 0.12 110.024 -179.015 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.492 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.65 140.29 5.83 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.06 -1.616 . . . . 0.12 109.06 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.464 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.26 64.09 2.0 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.286 -1.126 . . . . 0.18 110.537 -179.296 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.3 t-20 -118.85 100.0 7.11 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.376 -0.972 . . . . 0.88 108.376 178.018 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.76 -30.12 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.328 -0.857 . . . . 1.06 111.641 -179.107 . . . . . . . . 3 3 . 1 . 023 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -66.64 -29.85 69.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.875 -1.14 . . . . 1.61 109.76 -179.842 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 52.4 tttp -61.82 -33.92 75.01 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 109.043 -0.725 . . . . 1.45 109.043 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.48 -39.98 85.48 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.707 -0.849 . . . . 0.19 108.707 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.9 -43.96 97.38 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.232 -0.987 . . . . 2.1 110.854 -178.363 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.78 77.84 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.187 -0.946 . . . . 0.19 111.076 -178.362 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.4 HG21 ' CE1' ' A' ' 79' ' ' PHE . 19.6 m -64.74 -39.95 94.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.736 -1.228 . . . . 0.2 108.189 -179.104 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.429 ' O ' ' N ' ' A' ' 105' ' ' VAL . 74.1 mt -65.29 -47.13 88.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 107.671 -1.233 . . . . 0.16 107.671 178.397 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.479 ' O ' HG12 ' A' ' 105' ' ' VAL . 49.1 t30 -60.52 -35.47 76.06 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.657 -1.238 . . . . 0.95 107.657 179.562 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -69.98 -39.23 76.05 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 116.022 -0.535 . . . . 2.21 110.143 -179.33 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.685 ' HB2' HD11 ' A' ' 22' ' ' LEU . 84.6 mt -98.34 -4.45 34.92 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.061 -1.025 . . . . 0.25 111.398 -178.986 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.479 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.3 p . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.485 -1.385 . . . . 1.08 109.143 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm . . . . . 0 N--CA 1.5 2.029 0 N-CA-C 109.578 -0.527 . . . . 1.31 109.578 . . . . . . . . . 0 0 . 1 . 023 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.493 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 33.2 mm -130.42 142.49 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 121.855 -0.528 . . . . 0.15 109.721 -179.46 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 22.2 m -98.49 131.97 44.31 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 107.407 -1.331 . . . . 0.19 107.407 177.57 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.4 m -81.02 139.38 35.79 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.851 -1.155 . . . . 0.2 111.244 -178.2 . . . . . . . . 1 1 . 1 . 023 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.451 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.9 m95 -77.19 -18.28 57.87 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.292 -0.88 . . . . 0.21 109.409 178.882 . . . . . . . . 2 2 . 1 . 023 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 108.123 -1.066 . . . . 0.49 108.123 179.354 . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm . . . . . 0 N--CA 1.498 1.969 0 N-CA-C 109.205 -0.665 . . . . 1.67 109.205 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -93.37 125.16 37.82 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.742 -0.836 . . . . 0.31 108.742 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mm -99.86 113.59 35.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 N-CA-C 108.422 -0.955 . . . . 0.19 108.422 179.402 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -99.13 -1.04 40.42 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.116 -0.99 . . . . 2.25 109.915 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.3 p -155.38 154.51 32.09 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.108 -0.995 . . . . 0.15 110.999 -179.855 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 ttpp -61.49 -33.96 74.68 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.926 -1.138 . . . . 1.65 107.926 178.711 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 42.1 m -57.55 -44.12 84.95 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.32 -0.952 . . . . 0.23 108.555 -179.446 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.31 69.54 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.25 -0.906 . . . . 0.17 109.037 178.476 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.545 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.1 t80 -59.73 -43.2 94.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.257 -0.902 . . . . 0.14 109.028 -179.189 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -66.18 -40.52 90.53 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.688 -0.856 . . . . 1.31 108.688 179.467 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -64.64 -40.93 96.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.292 0.567 . . . . 1.77 110.562 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.9 -40.9 83.37 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.309 -0.869 . . . . 0.15 108.907 -178.972 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.545 HD11 ' CE2' ' A' ' 11' ' ' PHE . 58.0 mt -60.89 -40.03 91.5 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.343 -0.984 . . . . 0.17 108.343 179.197 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -69.99 -34.37 73.25 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.416 -0.803 . . . . 1.07 109.834 179.775 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.99 76.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.225 -0.922 . . . . 0.18 109.926 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.97 74.9 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 0.17 109.025 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.61 18.62 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.879 -1.288 . . . . 0.2 109.879 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -90.19 3.3 53.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.133 -1.216 . . . . 1.07 110.747 -179.053 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mtpt -77.06 149.99 35.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 1.5 109.51 -179.686 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.668 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.9 155.49 19.64 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.082 -1.081 . . . . 0.47 108.082 -179.39 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.668 ' H ' HD23 ' A' ' 22' ' ' LEU . 87.6 t -144.35 112.42 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.012 -1.055 . . . . 0.17 109.131 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -99.6 141.9 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.168 -1.049 . . . . 0.14 108.168 179.583 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.98 122.34 63.11 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.217 -0.927 . . . . 0.13 110.196 -178.542 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -99.24 122.94 43.09 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.646 -0.658 . . . . 1.05 109.775 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -99.26 18.54 17.33 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.264 -0.898 . . . . 0.73 109.925 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.5 m -52.05 147.87 6.82 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-O 122.063 0.935 . . . . 0.3 110.618 -178.791 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.803 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.76 123.9 31.66 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.444 -1.317 . . . . 0.22 107.444 178.743 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.77 -28.96 68.81 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.195 -1.002 . . . . 0.3 108.332 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.803 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 68.4 p-90 -78.02 -15.82 58.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.496 -0.753 . . . . 0.26 110.977 -179.515 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.7 t -88.22 116.55 26.5 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.877 -1.139 . . . . 0.26 108.04 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.42 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.37 -53.56 44.53 Favored Glycine 0 N--CA 1.489 2.193 0 C-N-CA 120.081 -1.057 . . . . 0.23 111.256 -178.521 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.99 -35.99 52.16 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.949 1.375 . . . . 0.31 111.612 179.895 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.92 -48.81 17.14 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.438 -0.789 . . . . 0.24 109.662 -179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.04 -37.81 80.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 1.59 109.47 179.514 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 33.0 tpp -59.12 -27.48 65.64 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.517 -0.74 . . . . 2.1 109.27 -179.393 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 38' ' ' ILE . 96.6 mt -80.94 -4.08 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.971 -0.456 . . . . 0.49 111.368 -179.772 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.536 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.08 5.83 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 120.283 -1.51 . . . . 0.8 113.916 -178.028 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.536 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 30.5 Cg_exo -58.89 -41.42 62.47 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 121.675 1.634 . . . . 0.28 112.379 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 41' ' ' PHE . . . . . 0.634 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 35.4 m-85 -69.13 -50.21 50.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.693 -1.255 . . . . 0.37 109.547 179.513 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -59.96 -50.82 72.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.027 -1.045 . . . . 0.16 109.447 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -67.54 -40.01 85.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.891 -0.506 . . . . 0.32 110.69 -179.423 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -63.29 -39.22 93.97 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.957 -1.089 . . . . 0.22 111.085 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.01 -23.43 63.67 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.194 -0.941 . . . . 0.22 110.203 -178.212 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.2 m -52.0 -40.15 60.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 118.72 -1.192 . . . . 0.16 108.765 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -82.82 -16.68 46.77 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.454 -0.779 . . . . 2.16 109.366 179.303 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -75.68 -37.44 59.55 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 107.362 -1.347 . . . . 1.78 107.362 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -124.75 68.71 1.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.077 -1.453 . . . . 0.25 107.077 177.894 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.4 p -62.28 -9.73 8.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.727 -0.842 . . . . 0.22 108.727 -179.255 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -91.92 9.84 31.29 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.644 -0.872 . . . . 1.13 108.644 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.8 t -127.58 144.82 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 107.639 -1.245 . . . . 0.24 107.639 178.981 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' CD1' ' A' ' 55' ' ' LEU . 27.2 mm -99.99 122.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.269 -0.895 . . . . 0.15 109.599 -178.55 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.471 ' C ' HD12 ' A' ' 55' ' ' LEU . 48.0 m-85 -103.06 126.81 50.41 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 108.692 -0.855 . . . . 0.12 108.692 179.25 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.471 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.0 mp -110.0 142.11 41.86 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.19 -0.944 . . . . 0.22 109.134 179.803 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -110.68 130.68 55.51 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 106.778 -1.564 . . . . 1.13 106.778 178.073 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.73 131.9 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.436 -0.79 . . . . 0.15 110.113 -178.333 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 45.6 t0 -96.1 119.89 35.4 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.518 -0.739 . . . . 1.05 109.599 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -67.98 -14.91 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.42 -1.425 . . . . 0.16 108.658 179.438 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.546 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 14.1 m-20 -94.45 -44.07 8.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.425 -0.797 . . . . 1.08 111.353 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -96.75 -18.63 19.49 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 120.776 -1.202 . . . . 1.07 108.836 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -119.03 36.59 4.4 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.346 -1.353 . . . . 0.14 107.346 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.579 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.4 OUTLIER -60.16 -23.55 64.03 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.961 -0.563 . . . . 1.47 110.277 -178.905 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -67.09 -35.43 79.77 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.001 -1.062 . . . . 1.05 108.633 179.5 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.419 HG23 ' OD1' ' A' ' 64' ' ' ASP . 5.6 t -73.36 -43.95 55.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.501 -0.749 . . . . 0.35 109.158 179.376 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.27 -40.77 74.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.393 -0.817 . . . . 0.26 110.957 -178.819 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.7 p -61.81 -32.71 73.04 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.71 -1.244 . . . . 0.24 109.287 -179.636 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -62.95 -38.16 89.97 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.282 -0.886 . . . . 2.06 109.075 179.344 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.54 2.04 55.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.558 -0.714 . . . . 0.23 111.081 -178.806 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 54.39 49.89 17.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.888 -1.133 . . . . 2.02 109.935 179.866 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.2 t -64.8 132.57 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 120.801 -1.187 . . . . 0.16 109.224 -179.114 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.95 -14.03 16.12 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.812 . . . . 1.6 110.056 -179.351 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.0 157.49 21.0 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.881 -1.137 . . . . 0.14 111.031 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -128.79 155.46 79.29 Favored Pre-proline 0 N--CA 1.499 1.99 0 N-CA-C 107.326 -1.361 . . . . 0.15 107.326 178.543 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -76.26 139.98 63.26 Favored 'Cis proline' 0 N--CA 1.49 1.288 0 C-N-CA 123.667 -1.389 . . . . 0.16 112.263 -2.178 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 99.1 m -124.56 139.53 53.79 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.491 -0.929 . . . . 0.13 108.491 178.038 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.471 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 95.4 m-85 -115.66 130.2 56.77 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.724 -0.843 . . . . 0.2 108.724 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -123.45 141.86 51.58 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.577 -0.897 . . . . 0.29 108.577 179.342 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 59.2 m-85 -108.37 137.25 46.65 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.528 0.68 . . . . 0.14 110.333 -179.229 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -129.91 147.31 51.66 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.377 0.608 . . . . 0.15 109.44 179.229 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -148.05 124.31 10.87 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.253 -1.388 . . . . 1.68 107.253 179.371 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 59.83 29.42 18.98 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.136 -1.061 . . . . 1.22 108.136 -178.235 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.59 15.23 81.72 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.611 -1.396 . . . . 0.23 109.611 -179.39 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -115.58 133.83 55.65 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.432 -1.04 . . . . 2.07 110.515 -179.222 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -78.68 124.38 28.13 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.27 -1.011 . . . . 1.82 108.27 178.217 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.7 m -123.93 9.14 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.558 -0.714 . . . . 0.3 110.968 -179.464 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.86 152.58 10.94 Favored Glycine 0 N--CA 1.498 2.816 0 C-N-CA 118.616 -1.754 . . . . 0.17 111.454 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -165.37 147.77 7.79 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.697 -0.884 . . . . 1.93 109.765 179.377 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -163.94 162.03 23.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 119.305 -0.958 . . . . 0.14 109.333 177.072 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -125.4 160.36 29.61 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.515 0.674 . . . . 0.12 109.551 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.493 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.03 141.02 5.95 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.907 -1.677 . . . . 0.12 108.907 179.747 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.426 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.15 66.31 2.28 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.256 -1.144 . . . . 0.18 109.168 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.1 t-20 -119.81 92.17 3.72 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.413 -0.804 . . . . 0.88 109.073 179.691 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.634 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.5 OUTLIER -68.08 -32.17 72.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.081 -1.012 . . . . 1.06 111.422 -179.791 . . . . . . . . 3 3 . 1 . 024 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -62.68 -30.13 71.17 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.81 -1.181 . . . . 1.61 109.075 -179.165 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -61.05 -35.66 77.53 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 109.115 -0.698 . . . . 1.45 109.115 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.68 -39.35 84.24 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-O 122.013 0.911 . . . . 0.19 108.892 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.09 -42.89 99.34 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.846 -0.742 . . . . 2.1 110.502 -177.769 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.97 -44.02 73.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.19 111.399 -178.998 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.9 m -66.3 -39.87 89.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.903 -1.123 . . . . 0.2 110.004 -178.499 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.68 -50.04 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.819 -1.178 . . . . 0.16 107.819 178.715 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.492 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.7 t-20 -60.01 -34.91 73.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.507 -0.923 . . . . 0.95 108.507 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -68.02 -40.04 83.02 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.581 -0.7 . . . . 2.21 110.368 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.666 ' HB2' HD11 ' A' ' 22' ' ' LEU . 92.2 mt -99.46 -2.03 37.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.32 -0.862 . . . . 0.25 111.451 -178.656 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 102' ' ' ASN . 7.7 p . . . . . 0 N--CA 1.498 1.965 0 O-C-N 120.568 -1.333 . . . . 1.08 109.298 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.614 -0.513 . . . . 1.31 109.614 . . . . . . . . . 0 0 . 1 . 024 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.493 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.2 mm -131.9 142.06 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.776 -0.577 . . . . 0.15 109.89 -179.101 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 17.9 m -99.7 125.26 45.54 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.937 -1.505 . . . . 0.19 106.937 177.157 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 69.5 m -77.99 140.89 39.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.897 -1.127 . . . . 0.2 110.386 -178.415 . . . . . . . . 1 1 . 1 . 024 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.423 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.1 m95 -75.06 -10.13 59.18 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.183 -0.948 . . . . 0.21 109.252 179.785 . . . . . . . . 2 2 . 1 . 024 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.334 -0.854 . . . . 0.49 108.862 179.784 . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 tptm . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 108.355 -0.98 . . . . 1.67 108.355 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -98.66 124.97 43.79 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.246 -0.909 . . . . 0.31 108.727 178.667 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.1 mm -103.38 113.28 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.551 -0.907 . . . . 0.19 108.551 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -98.26 0.0 44.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.316 -0.865 . . . . 2.25 110.04 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -151.63 155.42 38.35 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.042 -1.036 . . . . 0.15 111.217 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HZ2' ' HB3' ' A' ' 8' ' ' LYS . 9.8 ttpp -64.82 -31.87 73.3 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.491 -0.929 . . . . 1.65 108.491 178.321 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 93.5 m -57.44 -49.82 75.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.996 . . . . 0.23 109.465 -179.472 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.95 -29.58 67.84 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 119.416 -0.914 . . . . 0.17 108.863 179.015 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.487 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.1 t80 -59.78 -44.04 94.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.177 -0.952 . . . . 0.14 109.518 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -64.74 -43.08 94.5 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.542 -0.91 . . . . 1.31 108.542 -179.788 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.04 -37.5 87.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.762 -0.586 . . . . 1.77 110.171 179.468 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.48 -41.26 84.87 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.089 -1.007 . . . . 0.15 108.949 -179.089 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' A' ' 11' ' ' PHE . 82.4 mt -60.24 -39.85 88.17 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.188 -0.945 . . . . 0.17 108.828 179.239 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.55 -36.3 76.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.53 -0.731 . . . . 1.07 110.335 -179.555 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.39 -35.93 76.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.316 -0.865 . . . . 0.18 110.512 -178.725 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.35 -30.95 71.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.106 -0.996 . . . . 0.17 109.301 -179.697 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.22 -125.85 24.88 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.465 -1.454 . . . . 0.2 109.465 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -92.17 5.16 51.42 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.294 -1.121 . . . . 1.07 110.729 -179.304 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.69 148.88 40.16 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.79 -1.194 . . . . 1.5 108.947 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.69 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -59.82 159.82 8.42 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 106.638 -1.616 . . . . 0.47 106.638 -179.973 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.69 ' H ' HD23 ' A' ' 22' ' ' LEU . 78.8 t -147.35 111.06 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 120.75 -1.219 . . . . 0.17 108.937 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -101.34 144.16 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.255 -1.017 . . . . 0.14 108.255 179.526 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.2 t -126.66 121.66 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.333 -0.854 . . . . 0.13 109.52 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.7 t70 -99.28 119.94 38.74 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.284 -0.885 . . . . 1.05 110.051 179.499 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -95.52 21.96 7.62 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.145 -0.972 . . . . 0.73 109.645 178.92 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.81 147.86 18.05 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.818 -1.176 . . . . 0.3 110.305 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.501 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.56 126.59 34.58 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.174 -1.047 . . . . 0.22 108.174 179.422 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -67.91 -30.21 69.48 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.207 -0.997 . . . . 0.3 109.191 -179.462 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 59.2 p-90 -75.79 -18.06 59.64 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.076 -1.05 . . . . 0.26 110.15 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.0 t -83.8 121.64 27.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.979 -1.075 . . . . 0.26 108.402 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.39 -55.03 28.01 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 121.518 -0.739 . . . . 0.23 112.534 -178.005 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.8 Cg_endo -60.7 -29.93 89.35 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 119.412 1.606 . . . . 0.31 112.09 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.61 -49.76 20.41 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.118 -1.067 . . . . 0.24 108.118 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.37 -32.35 71.21 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.158 -1.053 . . . . 1.59 108.158 177.962 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -57.88 -28.04 63.82 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.007 -0.542 . . . . 2.1 110.112 -179.334 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.84 HD11 ' HB1' ' A' ' 92' ' ' ALA . 81.9 mt -85.25 -0.92 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.458 -0.776 . . . . 0.49 111.573 -178.926 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.74 -30.75 6.84 Favored Pre-proline 0 C--N 1.302 -1.497 0 O-C-N 120.263 -1.523 . . . . 0.8 113.045 -178.768 . . . . . . . . 3 3 . 1 . 025 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.7 Cg_exo -59.7 -44.21 33.04 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 121.542 1.586 . . . . 0.28 112.91 -178.124 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -69.54 -45.38 68.93 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 118.36 -1.336 . . . . 0.37 108.948 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -61.31 -52.29 65.32 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.988 -1.07 . . . . 0.16 109.701 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -68.07 -42.49 80.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.536 -0.727 . . . . 0.32 111.548 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.1 m -62.74 -39.87 95.46 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.882 -1.136 . . . . 0.22 110.79 -179.202 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.5 mt -61.32 -23.78 65.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.331 -0.856 . . . . 0.22 110.755 -178.338 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.8 m -54.27 -35.32 62.41 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.094 -1.004 . . . . 0.16 109.009 -178.89 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -88.3 -13.0 41.92 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.082 -1.011 . . . . 2.16 108.734 179.183 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -80.52 -37.51 31.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.445 -1.317 . . . . 1.78 107.445 178.408 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -121.9 68.2 0.92 Allowed 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.986 -1.487 . . . . 0.25 106.986 178.138 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.1 p -64.01 -9.71 17.49 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 108.492 -0.929 . . . . 0.22 108.492 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -90.47 7.73 37.42 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.312 -0.996 . . . . 1.13 108.312 178.805 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.476 HG13 ' HB3' ' A' ' 22' ' ' LEU . 45.7 t -127.23 143.32 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 107.415 -1.328 . . . . 0.24 107.415 178.819 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.1 mm -99.78 124.13 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.097 -1.002 . . . . 0.15 109.501 -178.516 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.565 ' C ' HD12 ' A' ' 55' ' ' LEU . 40.0 m-85 -104.15 127.31 51.74 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.333 -0.855 . . . . 0.12 109.503 179.188 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.565 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.6 mp -110.42 139.86 45.21 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.3 -0.875 . . . . 0.22 109.218 178.239 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -110.06 130.34 55.55 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 106.982 -1.488 . . . . 1.13 106.982 178.164 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.4 t -128.28 134.04 65.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.354 -0.841 . . . . 0.15 110.74 -177.834 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.0 t0 -95.86 119.43 34.34 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.011 -0.737 . . . . 1.05 109.011 179.45 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.23 -16.38 20.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.476 -1.39 . . . . 0.16 108.39 179.223 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.85 -41.47 9.62 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 1.08 111.261 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 25.6 m-20 -95.74 -22.2 17.68 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.844 -1.16 . . . . 1.07 108.747 179.81 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -118.46 39.92 3.34 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.866 -1.161 . . . . 0.14 107.866 179.534 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -60.08 -22.1 62.31 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.785 -0.572 . . . . 1.47 110.059 -178.469 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.587 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.701 -1.249 . . . . 1.05 109.196 179.665 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.587 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.5 t -73.68 -43.99 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.05 -1.031 . . . . 0.35 109.395 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.91 75.77 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.26 110.477 -178.743 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.8 p -60.77 -33.45 72.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.011 -1.056 . . . . 0.24 109.129 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -62.07 -39.87 93.87 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.406 -0.809 . . . . 2.06 109.438 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.414 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -88.76 1.34 55.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.313 -0.867 . . . . 0.23 111.162 -178.318 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 55.07 49.64 17.08 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.253 -0.905 . . . . 2.02 109.034 -179.291 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.78 130.7 28.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.41 -1.33 . . . . 0.16 107.41 -179.504 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -102.88 -12.12 17.76 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.624 -0.673 . . . . 1.6 109.998 -178.779 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.45 156.3 20.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.845 -1.159 . . . . 0.14 111.26 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.489 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.4 p -124.6 154.62 69.97 Favored Pre-proline 0 N--CA 1.499 2.01 0 N-CA-C 108.133 -1.062 . . . . 0.15 108.133 178.933 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -77.32 145.52 80.59 Favored 'Cis proline' 0 N--CA 1.492 1.406 0 C-N-CA 123.542 -1.441 . . . . 0.16 112.359 -3.115 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.41 131.1 48.47 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 108.564 -0.902 . . . . 0.13 108.564 178.125 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.799 ' CD1' HD21 ' A' ' 97' ' ' LEU . 89.8 m-85 -109.84 130.16 55.56 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.631 -0.668 . . . . 0.2 109.455 -179.207 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.414 HE22 ' CB ' ' A' ' 69' ' ' ALA . 72.2 mt-30 -120.63 140.45 51.54 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.41 -0.807 . . . . 0.29 109.04 179.104 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.9 131.97 53.95 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 121.117 0.484 . . . . 0.14 110.077 -179.341 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -124.84 145.83 49.58 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.492 0.663 . . . . 0.15 109.432 179.439 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -146.27 127.35 14.65 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.325 -1.361 . . . . 1.68 107.325 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.1 mttt 54.95 33.25 19.69 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.319 -0.863 . . . . 1.22 110.072 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.9 21.5 76.29 Favored Glycine 0 N--CA 1.491 2.312 0 O-C-N 120.913 -1.117 . . . . 0.23 110.921 178.899 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -131.02 141.51 50.23 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.209 -1.171 . . . . 2.07 109.786 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -77.67 126.84 31.49 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.98 -1.075 . . . . 1.82 109.51 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.0 m -122.25 12.1 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.766 -0.584 . . . . 0.3 110.187 -179.472 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.33 152.04 10.72 Favored Glycine 0 N--CA 1.493 2.447 0 C-N-CA 118.681 -1.723 . . . . 0.17 111.268 179.645 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.5 tp10 -163.04 137.49 6.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.819 -0.812 . . . . 1.93 109.451 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.483 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.2 p90 -163.37 158.82 21.68 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.591 -0.844 . . . . 0.14 109.976 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -125.97 161.66 27.0 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-O 121.326 0.584 . . . . 0.12 109.792 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.455 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.6 141.71 5.89 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.639 -1.384 . . . . 0.12 109.639 179.36 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.84 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.59 67.28 5.3 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.134 -1.216 . . . . 0.18 109.669 -179.932 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 99.01 6.36 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 108.684 -0.858 . . . . 0.88 108.684 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -35.03 75.26 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.157 -0.964 . . . . 1.06 111.479 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -64.13 -30.04 71.12 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.992 -1.067 . . . . 1.61 109.657 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.96 -37.4 82.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.693 -0.63 . . . . 1.45 109.612 -179.643 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.799 HD21 ' CD1' ' A' ' 77' ' ' PHE . 47.3 mt -58.77 -38.49 78.6 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.438 -0.949 . . . . 0.19 108.438 179.672 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -63.99 -40.68 96.91 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 120.252 -0.579 . . . . 2.1 110.748 -178.444 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.09 -43.92 73.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.082 -1.011 . . . . 0.19 111.651 -178.567 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.29 -40.01 93.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.759 -1.213 . . . . 0.2 109.923 -178.777 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.36 -51.63 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.255 -0.903 . . . . 0.16 108.982 -179.733 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.3 t30 -60.33 -34.24 73.54 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.334 -0.988 . . . . 0.95 108.334 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -68.05 -39.91 82.91 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.611 -0.681 . . . . 2.21 110.426 -178.823 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.561 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.8 mt -99.58 -1.98 36.82 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.284 -0.885 . . . . 0.25 110.971 -178.666 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.667 -1.271 . . . . 1.08 109.3 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 108.963 -0.754 . . . . 1.31 108.963 . . . . . . . . . 0 0 . 1 . 025 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.455 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.6 mm -128.41 140.34 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.558 -0.534 . . . . 0.15 109.558 -179.68 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.5 m -100.58 124.63 46.42 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 107.102 -1.444 . . . . 0.19 107.102 178.002 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -75.51 140.04 42.55 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.94 -1.1 . . . . 0.2 111.468 -177.873 . . . . . . . . 1 1 . 1 . 025 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.489 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.8 m95 -75.42 -10.23 59.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.21 108.807 178.779 . . . . . . . . 2 2 . 1 . 025 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 . . . . . 0 N--CA 1.492 1.661 0 N-CA-C 108.582 -0.895 . . . . 0.49 108.582 179.319 . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.0 tptp . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 108.521 -0.918 . . . . 1.67 108.521 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -98.6 124.14 43.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.493 -0.755 . . . . 0.31 109.429 179.784 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.26 113.98 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 108.329 -0.989 . . . . 0.19 108.329 178.976 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -98.65 -0.52 42.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 2.25 109.689 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -155.25 157.89 37.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.057 -1.027 . . . . 0.15 110.948 179.782 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -65.16 -30.96 71.92 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.777 -1.194 . . . . 1.65 107.777 178.43 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.8 m -58.98 -47.36 85.44 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.327 -0.858 . . . . 0.23 108.941 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.1 -29.76 68.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.697 -0.853 . . . . 0.17 108.697 178.702 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.527 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.0 t80 -59.72 -44.78 93.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.227 -0.92 . . . . 0.14 109.259 -179.683 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -64.27 -43.65 94.19 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 121.809 0.814 . . . . 1.31 108.992 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.17 -37.36 87.12 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.341 0.591 . . . . 1.77 110.804 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.74 82.88 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.34 -0.85 . . . . 0.15 108.891 -179.373 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.527 HD11 ' CE2' ' A' ' 11' ' ' PHE . 63.3 mt -60.55 -40.2 90.71 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.352 -0.843 . . . . 0.17 108.791 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.26 -32.53 70.39 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.379 -0.825 . . . . 1.07 109.829 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.44 79.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.298 -0.876 . . . . 0.18 109.768 -179.078 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.83 76.36 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.17 109.317 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.89 -123.92 16.3 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.963 -1.255 . . . . 0.2 109.963 -179.734 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.42 2.3 54.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.971 -1.311 . . . . 1.07 110.589 -178.876 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -74.45 148.45 41.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.84 -1.162 . . . . 1.5 109.169 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.693 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -60.37 159.4 10.22 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.773 -1.566 . . . . 0.47 106.773 179.708 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.693 ' H ' HD23 ' A' ' 22' ' ' LEU . 88.7 t -146.93 113.49 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 120.78 -1.2 . . . . 0.17 108.983 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -101.35 141.75 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 107.964 -1.125 . . . . 0.14 107.964 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.0 t -124.58 120.62 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.397 -0.814 . . . . 0.13 109.377 -179.226 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.7 t70 -99.47 118.66 36.56 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.418 -0.801 . . . . 1.05 110.447 179.595 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -95.06 24.15 5.1 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.513 -0.742 . . . . 0.73 109.735 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.405 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.4 m -59.0 145.12 43.01 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.993 -1.067 . . . . 0.3 109.671 -178.835 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.734 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.33 124.04 31.5 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.462 -1.31 . . . . 0.22 107.462 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -67.84 -31.79 71.87 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.102 -1.073 . . . . 0.3 108.102 179.838 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.734 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.0 p-90 -70.54 -23.04 62.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.745 -0.597 . . . . 0.26 110.584 179.629 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -83.95 116.46 22.81 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.333 -1.358 . . . . 0.26 107.333 179.54 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.54 -50.83 63.55 Favored Glycine 0 N--CA 1.49 2.294 0 C-N-CA 120.514 -0.851 . . . . 0.23 111.503 -177.692 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.8 Cg_exo -54.56 -35.02 84.9 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 CA-C-N 118.518 1.159 . . . . 0.31 112.052 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.69 -47.85 16.14 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.835 . . . . 0.24 109.642 -179.83 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -60.12 -33.13 71.71 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.193 -1.04 . . . . 1.59 108.193 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.9 tpt -59.78 -30.17 68.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.837 -0.539 . . . . 2.1 109.725 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.557 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.5 mt -83.87 -2.04 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.705 -0.622 . . . . 0.49 110.88 -178.603 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.72 -30.81 7.56 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 120.423 -1.423 . . . . 0.8 113.028 -178.561 . . . . . . . . 3 3 . 1 . 026 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 24.4 Cg_exo -59.93 -42.17 47.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 CA-C-N 121.641 1.622 . . . . 0.28 112.826 -177.549 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -68.52 -45.98 70.79 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 118.628 -1.229 . . . . 0.37 108.767 -179.78 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -63.12 -51.97 64.4 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.977 -1.077 . . . . 0.16 109.572 179.002 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -67.46 -40.1 85.35 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.707 -0.62 . . . . 0.32 111.106 -179.444 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.8 m -63.88 -36.29 83.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.878 -1.139 . . . . 0.22 110.752 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.56 -20.82 65.95 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.212 -0.93 . . . . 0.22 110.656 -177.887 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.1 m -54.93 -36.46 65.29 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.917 -1.114 . . . . 0.16 108.632 -179.648 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.7 mp0 -88.18 -15.95 34.65 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.131 -0.98 . . . . 2.16 109.9 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -79.3 -37.42 37.76 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 107.169 -1.419 . . . . 1.78 107.169 179.147 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 49' ' ' TYR . . . . . 0.405 ' C ' ' H ' ' A' ' 51' ' ' ASN . 77.6 m-85 -123.77 67.01 1.03 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 107.374 -1.343 . . . . 0.25 107.374 178.169 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.6 p -63.35 -5.72 3.86 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.14 -1.059 . . . . 0.22 108.14 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 51' ' ' ASN . . . . . 0.405 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.7 t-20 -79.99 -20.41 45.54 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.223 -0.658 . . . . 1.13 109.223 178.647 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 22' ' ' LEU . 60.8 t -107.01 149.46 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 108.774 -0.824 . . . . 0.24 108.774 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.8 mm -99.79 120.0 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.258 -0.901 . . . . 0.15 108.678 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.604 ' C ' HD12 ' A' ' 55' ' ' LEU . 44.2 m-85 -99.63 126.15 45.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.238 -0.914 . . . . 0.12 110.221 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.604 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -111.49 141.59 44.86 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.225 -0.922 . . . . 0.22 109.35 178.78 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -109.23 132.1 54.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 106.853 -1.536 . . . . 1.13 106.853 178.338 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.0 t -127.89 131.09 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.448 -0.782 . . . . 0.15 109.858 -178.052 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.685 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.5 t0 -94.27 120.31 34.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.436 -0.79 . . . . 1.05 108.898 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.0 m -67.46 -19.52 25.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 120.627 -1.296 . . . . 0.16 108.329 179.203 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.53 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 17.6 m-20 -92.03 -45.04 8.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.509 -0.744 . . . . 1.08 111.726 -179.271 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.448 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 18.1 m-20 -93.97 -13.59 26.87 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.566 -1.334 . . . . 1.07 108.195 179.553 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 36.98 4.51 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.734 -1.21 . . . . 0.14 107.734 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -60.03 -24.43 64.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.687 -0.633 . . . . 1.47 109.645 -178.803 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.538 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -66.67 -38.61 87.17 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.875 -1.141 . . . . 1.05 108.33 178.793 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.538 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.8 t -69.23 -44.54 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.395 -0.816 . . . . 0.35 109.626 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.56 -37.22 68.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.371 -0.831 . . . . 0.26 110.726 -178.664 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -60.24 -37.41 80.27 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.165 -0.959 . . . . 0.24 109.753 -178.785 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.07 -38.68 92.16 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.342 -0.849 . . . . 2.06 109.26 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 69' ' ' ALA . . . . . 0.408 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.74 -1.46 56.28 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.47 -0.769 . . . . 0.23 111.014 -178.816 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 53.84 48.29 21.66 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.027 -1.046 . . . . 2.02 109.596 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.8 t -63.22 134.37 28.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 C-N-CA 118.787 -1.165 . . . . 0.16 108.142 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -106.92 -12.3 15.5 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.563 -0.71 . . . . 1.6 109.797 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.471 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 154.53 19.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 0.14 110.911 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -127.62 154.5 77.69 Favored Pre-proline 0 N--CA 1.496 1.864 0 N-CA-C 107.726 -1.212 . . . . 0.15 107.726 178.611 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.6 143.25 73.75 Favored 'Cis proline' 0 N--CA 1.489 1.248 0 C-N-CA 123.57 -1.429 . . . . 0.16 112.569 -2.183 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.5 m -128.37 133.84 48.72 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.869 -0.789 . . . . 0.13 108.869 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.519 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.1 m-85 -110.71 131.02 55.41 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.632 -0.877 . . . . 0.2 108.632 -179.413 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 78' ' ' GLN . . . . . 0.408 HE22 ' HB1' ' A' ' 69' ' ' ALA . 72.3 mt-30 -122.47 140.19 53.02 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.533 -0.914 . . . . 0.29 108.533 179.429 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -106.63 132.94 52.05 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.377 0.608 . . . . 0.14 109.931 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -126.87 145.68 50.57 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 109.013 -0.736 . . . . 0.15 109.013 179.248 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -145.86 129.41 16.99 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 106.938 -1.505 . . . . 1.68 106.938 179.26 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.4 mttt 56.55 27.96 13.15 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.241 -0.912 . . . . 1.22 108.594 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.94 25.02 67.83 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.689 -1.364 . . . . 0.23 109.689 -179.75 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -128.69 136.18 50.26 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.394 -1.062 . . . . 2.07 110.362 -179.82 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -79.38 128.15 32.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.236 -0.915 . . . . 1.82 109.654 179.461 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.4 m -123.93 3.98 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.76 -0.587 . . . . 0.3 110.377 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.22 155.89 17.1 Favored Glycine 0 N--CA 1.496 2.639 0 C-N-CA 118.648 -1.739 . . . . 0.17 111.506 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -164.04 148.7 10.21 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.865 -0.785 . . . . 1.93 109.482 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 6.3 p90 -164.37 157.33 17.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.613 -0.835 . . . . 0.14 109.913 178.218 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.2 p -125.8 160.41 29.89 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.391 0.615 . . . . 0.12 109.673 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.481 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.01 141.7 5.84 Favored Glycine 0 N--CA 1.487 2.052 0 N-CA-C 109.125 -1.59 . . . . 0.12 109.125 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.457 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.01 65.76 2.1 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.378 -1.072 . . . . 0.18 109.57 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -119.99 96.98 5.39 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.217 -0.927 . . . . 0.88 108.567 179.062 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -31.95 70.25 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.12 -0.988 . . . . 1.06 111.722 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.28 -29.85 70.93 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.793 -1.192 . . . . 1.61 108.914 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.04 -35.73 77.68 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.705 -0.622 . . . . 1.45 109.403 -179.434 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 56.3 mt -59.88 -39.86 86.76 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.136 0.97 . . . . 0.19 108.508 179.252 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -61.99 -43.76 98.16 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.755 -0.657 . . . . 2.1 111.087 -177.677 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.93 -44.1 73.74 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.035 -1.041 . . . . 0.19 111.659 -178.323 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -66.13 -40.2 90.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.87 -1.144 . . . . 0.2 110.165 -178.444 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.36 -50.11 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.036 -1.04 . . . . 0.16 108.548 179.351 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.461 ' O ' HG12 ' A' ' 105' ' ' VAL . 24.9 t-20 -59.94 -36.39 76.95 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.905 0.86 . . . . 0.95 108.846 179.209 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -67.72 -39.9 84.28 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.812 -0.555 . . . . 2.21 109.846 -178.644 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.687 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.8 mt -97.56 -4.53 37.58 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.152 -0.968 . . . . 0.25 111.267 -179.201 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.461 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.0 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 120.411 -1.431 . . . . 1.08 109.285 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.129 -0.693 . . . . 1.31 109.129 . . . . . . . . . 0 0 . 1 . 026 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.481 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.1 mm -130.04 140.27 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 122.045 -0.409 . . . . 0.15 110.232 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 27.8 m -98.9 130.54 45.3 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 177.497 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.1 m -81.25 144.79 31.31 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.721 -1.237 . . . . 0.2 110.875 -178.189 . . . . . . . . 1 1 . 1 . 026 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.471 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.0 m95 -79.72 -15.49 57.42 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.236 -0.915 . . . . 0.21 109.53 178.727 . . . . . . . . 2 2 . 1 . 026 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 39.3 m-20 . . . . . 0 C--N 1.303 -1.442 0 N-CA-C 107.465 -1.309 . . . . 0.49 107.465 179.126 . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.1 tttp . . . . . 0 N--CA 1.496 1.854 0 N-CA-C 109.037 -0.727 . . . . 1.67 109.037 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -96.56 125.45 41.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.403 -0.811 . . . . 0.31 109.075 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 45.3 mm -100.32 111.26 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 N-CA-C 108.517 -0.92 . . . . 0.19 108.517 179.348 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 54.1 mp0 -98.88 -1.16 40.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.176 -0.952 . . . . 2.25 108.613 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -155.17 156.91 36.55 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.366 -0.834 . . . . 0.15 110.378 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' HZ1' ' HB2' ' A' ' 68' ' ' GLU . 15.4 ttmm -62.92 -33.37 75.2 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.195 -1.039 . . . . 1.65 108.195 178.509 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.0 m -53.59 -49.51 67.63 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.524 -0.87 . . . . 0.23 109.213 -178.55 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -30.48 69.37 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.334 -0.854 . . . . 0.17 109.165 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.526 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.0 t80 -58.49 -45.28 89.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.897 -1.127 . . . . 0.14 108.927 -179.478 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -64.88 -41.78 95.36 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.484 -0.76 . . . . 1.31 109.134 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.73 -39.72 94.12 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 1.77 110.819 -179.763 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.59 82.08 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.044 -1.035 . . . . 0.15 109.016 -179.31 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.526 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.6 mt -60.22 -41.71 93.65 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.938 -1.134 . . . . 0.17 107.938 179.165 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.49 -37.02 77.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.572 -0.705 . . . . 1.07 110.273 179.813 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.24 -39.64 82.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 0.18 110.429 -179.203 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.23 -27.91 69.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.91 . . . . 0.17 108.952 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.04 -126.36 28.78 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.625 -1.39 . . . . 0.2 109.625 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -90.69 4.52 51.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.118 -1.225 . . . . 1.07 110.059 -179.192 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 21' ' ' LYS . . . . . 0.413 ' HZ2' ' HG2' ' A' ' 21' ' ' LYS . 26.7 mtpp -74.75 150.52 39.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.873 -1.142 . . . . 1.5 109.079 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.653 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -59.62 159.5 8.41 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.511 -1.292 . . . . 0.47 107.511 -179.253 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.653 ' H ' HD23 ' A' ' 22' ' ' LEU . 61.8 t -147.25 116.89 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 120.993 -1.067 . . . . 0.17 108.3 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.31 144.01 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.211 -1.033 . . . . 0.14 108.211 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.4 t -125.24 123.78 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.38 -0.825 . . . . 0.13 109.938 -179.322 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -100.98 120.16 39.77 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.28 -0.888 . . . . 1.05 110.075 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -95.87 22.41 7.41 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.925 -1.109 . . . . 0.73 110.107 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -58.12 149.0 24.81 Favored 'General case' 0 C--N 1.296 -1.745 0 O-C-N 120.969 -1.082 . . . . 0.3 110.494 -178.057 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.596 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.59 124.18 31.85 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.963 -1.125 . . . . 0.22 107.963 179.389 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -65.18 -32.07 73.57 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 118.78 -1.168 . . . . 0.3 108.21 -179.795 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.596 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 51.9 p-90 -72.38 -24.37 61.25 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.326 -0.859 . . . . 0.26 111.495 179.672 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -82.8 116.65 22.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.584 -1.322 . . . . 0.26 109.304 -178.741 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.442 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.12 -51.98 54.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 111.267 -0.733 . . . . 0.23 111.267 -178.753 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.6 Cg_exo -50.98 -34.97 48.5 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 CA-C-N 118.776 1.288 . . . . 0.31 111.673 179.518 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.8 -47.45 15.17 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.39 -0.818 . . . . 0.24 109.637 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.74 -33.14 71.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.06 -1.025 . . . . 1.59 108.863 179.141 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 23.5 ttt -58.34 -26.21 62.84 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.516 -0.74 . . . . 2.1 109.969 179.366 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.489 HG22 ' O ' ' A' ' 38' ' ' ILE . 43.7 mt -86.27 -2.36 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.406 -0.809 . . . . 0.49 111.14 -178.705 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.553 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -63.38 -30.56 5.51 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 120.187 -1.571 . . . . 0.8 113.298 -177.533 . . . . . . . . 3 3 . 1 . 027 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 29.3 Cg_exo -60.15 -41.27 53.03 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 CA-C-N 121.492 1.569 . . . . 0.28 112.375 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -68.63 -48.52 63.86 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.797 -1.189 . . . . 0.37 109.534 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -60.91 -51.94 67.14 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.154 -0.967 . . . . 0.16 109.151 179.046 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -65.72 -43.31 89.48 Favored 'General case' 0 C--N 1.292 -1.892 0 O-C-N 121.691 -0.63 . . . . 0.32 110.747 179.634 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.5 m -62.77 -39.49 94.35 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.829 -1.169 . . . . 0.22 111.392 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.7 -20.06 63.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.97 -1.082 . . . . 0.22 110.159 -178.201 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.5 m -53.98 -39.71 66.26 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.974 -1.09 . . . . 0.16 108.284 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -83.07 -18.16 40.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.044 -1.035 . . . . 2.16 109.867 178.856 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -76.85 -35.69 57.34 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.244 -1.391 . . . . 1.78 107.244 179.597 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -123.8 67.11 1.03 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.405 -1.332 . . . . 0.25 107.405 178.183 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.3 p -64.28 -10.42 23.78 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 108.868 -0.79 . . . . 0.22 108.868 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -90.23 8.45 33.09 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.04 -1.096 . . . . 1.13 108.04 179.161 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 22' ' ' LEU . 40.3 t -127.16 143.65 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 107.483 -1.303 . . . . 0.24 107.483 178.598 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.405 HG22 ' CD1' ' A' ' 55' ' ' LEU . 27.7 mm -98.99 121.22 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.222 -0.924 . . . . 0.15 109.614 -178.375 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.447 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.3 m-85 -99.15 127.88 45.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.12 109.403 179.392 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.447 HD12 ' C ' ' A' ' 54' ' ' PHE . 2.8 mp -111.7 146.36 37.65 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.349 -0.845 . . . . 0.22 109.333 178.903 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -116.04 129.83 56.54 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.775 -1.565 . . . . 1.13 106.775 177.778 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.8 t -126.79 132.78 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 CA-C-O 121.547 0.689 . . . . 0.15 109.827 -178.359 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 53.7 t0 -97.98 118.92 35.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.535 -0.913 . . . . 1.05 108.535 179.626 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.2 m -65.57 -20.87 28.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 120.252 -1.53 . . . . 0.16 108.247 179.292 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.524 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 3.4 m-20 -92.14 -41.51 10.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.517 -0.739 . . . . 1.08 112.406 -177.982 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.424 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 65.6 m-20 -95.49 -20.98 18.61 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.402 -1.436 . . . . 1.07 108.437 179.223 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.98 43.42 2.79 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 108.238 -1.023 . . . . 0.14 108.238 179.258 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -61.56 -19.3 62.01 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.615 -0.678 . . . . 1.47 109.645 -179.144 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.651 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -62.8 -40.47 97.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.105 -0.997 . . . . 1.05 109.583 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.651 HG23 ' OD1' ' A' ' 64' ' ' ASP . 22.2 t -72.31 -43.45 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.244 -0.91 . . . . 0.35 109.69 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.49 -39.16 74.33 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.647 -0.658 . . . . 0.26 111.371 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -61.21 -36.0 78.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.983 -1.073 . . . . 0.24 109.191 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.467 ' HB2' ' HZ1' ' A' ' 8' ' ' LYS . 14.1 tm-20 -64.97 -39.67 93.84 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.527 -0.733 . . . . 2.06 109.24 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.15 -3.2 58.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.23 110.791 -178.987 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 55.51 50.31 14.88 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.002 -1.062 . . . . 2.02 109.746 -179.709 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.62 134.03 28.91 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 C-N-CA 118.627 -1.229 . . . . 0.16 108.63 -179.049 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -105.0 -12.72 16.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.67 -0.644 . . . . 1.6 110.23 -179.197 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.466 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 155.55 20.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.908 -1.12 . . . . 0.14 110.92 179.526 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.423 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.1 p -128.91 154.45 80.2 Favored Pre-proline 0 N--CA 1.499 1.983 0 N-CA-C 107.455 -1.313 . . . . 0.15 107.455 178.582 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -76.91 143.17 74.92 Favored 'Cis proline' 0 N--CA 1.492 1.43 0 C-N-CA 123.985 -1.256 . . . . 0.16 112.854 -1.565 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.0 m -130.0 134.75 47.63 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.044 -0.724 . . . . 0.13 109.044 178.55 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -110.58 130.16 55.63 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.378 0.608 . . . . 0.2 109.777 -179.385 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -120.98 139.94 52.58 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 108.189 -1.041 . . . . 0.29 108.189 179.29 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -105.84 134.97 48.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.669 -0.644 . . . . 0.14 110.126 -178.94 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -129.45 145.85 51.37 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.709 0.766 . . . . 0.15 109.577 179.266 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -149.09 131.18 15.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.372 -1.714 . . . . 1.68 106.372 179.072 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.6 mttt 57.33 30.08 17.92 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.186 -0.946 . . . . 1.22 109.575 -178.766 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.56 18.31 79.84 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.451 -1.06 . . . . 0.23 110.451 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -127.52 142.88 51.27 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.388 -1.066 . . . . 2.07 109.654 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -80.06 131.55 35.79 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.432 -0.792 . . . . 1.82 109.324 179.572 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.1 m -121.8 11.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.814 -0.554 . . . . 0.3 110.374 -179.638 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 167.49 161.54 17.18 Favored Glycine 0 N--CA 1.498 2.805 0 C-N-CA 118.42 -1.848 . . . . 0.17 112.012 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -165.32 149.23 8.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.872 -0.781 . . . . 1.93 110.198 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 12.1 p90 -162.84 160.59 25.3 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.078 -1.014 . . . . 0.14 109.135 177.876 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.29 164.9 20.0 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 121.492 0.663 . . . . 0.12 109.932 -178.914 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.483 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.74 142.38 6.68 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.072 -1.611 . . . . 0.12 109.072 179.862 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.409 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -78.78 62.96 3.41 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.272 -1.134 . . . . 0.18 109.495 -179.82 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -116.72 97.37 5.94 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.475 -0.766 . . . . 0.88 109.015 179.398 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -32.66 72.4 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.332 -0.855 . . . . 1.06 111.265 -179.704 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.87 -30.04 71.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.044 -1.035 . . . . 1.61 109.934 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -61.23 -35.95 78.64 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.626 0.727 . . . . 1.45 109.206 -179.1 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.9 mt -59.52 -39.43 83.84 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 122.253 1.025 . . . . 0.19 108.968 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -62.43 -43.07 99.69 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 119.824 -0.75 . . . . 2.1 110.745 -177.797 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.15 69.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.951 -1.093 . . . . 0.19 111.031 -178.867 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.3 m -63.97 -40.16 95.77 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 0.2 109.874 -178.714 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.7 mt -61.29 -50.02 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 N-CA-C 107.849 -1.167 . . . . 0.16 107.849 178.784 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.471 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.2 t-20 -60.26 -35.08 74.68 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.693 -0.855 . . . . 0.95 108.693 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -67.65 -38.57 84.0 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.418 -0.801 . . . . 2.21 109.881 -178.639 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HB2' HD11 ' A' ' 22' ' ' LEU . 84.0 mt -99.21 -4.16 32.68 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.065 -1.022 . . . . 0.25 111.405 -179.463 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.471 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.496 1.868 0 O-C-N 120.538 -1.351 . . . . 1.08 109.164 -179.177 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.536 -0.542 . . . . 1.31 109.536 . . . . . . . . . 0 0 . 1 . 027 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.483 HD11 ' HA2' ' A' ' 91' ' ' GLY . 35.3 mm -130.28 139.88 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.856 -0.528 . . . . 0.15 110.404 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.6 m -98.17 125.38 43.17 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 107.524 -1.287 . . . . 0.19 107.524 177.334 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -77.93 145.07 36.34 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.831 -1.168 . . . . 0.2 111.689 -178.348 . . . . . . . . 1 1 . 1 . 027 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.466 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.6 m95 -76.7 -12.02 59.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.805 . . . . 0.21 108.976 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.031 -1.043 . . . . 0.49 108.485 179.654 . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 N--CA 1.5 2.028 0 N-CA-C 108.889 -0.782 . . . . 1.67 108.889 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -95.96 124.22 39.88 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.888 -1.132 . . . . 0.31 108.595 178.74 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.4 mm -102.0 112.03 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.341 -0.849 . . . . 0.19 109.329 179.57 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.48 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.1 mp0 -97.21 -1.0 45.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.946 . . . . 2.25 109.372 179.836 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -154.87 157.62 38.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.59 -1.319 . . . . 0.15 111.208 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.419 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 34.4 ttmt -63.88 -32.48 74.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.017 -1.105 . . . . 1.65 108.017 177.648 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.4 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 52.1 m -56.28 -46.43 79.74 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.319 -0.952 . . . . 0.23 108.841 -178.82 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.59 -30.25 66.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.256 -0.902 . . . . 0.17 109.166 178.745 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.51 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.8 t80 -59.86 -43.81 94.47 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.397 -0.815 . . . . 0.14 108.974 -179.025 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -65.55 -42.96 91.31 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.693 0.759 . . . . 1.31 109.819 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -66.52 -39.7 88.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.556 -0.715 . . . . 1.77 110.06 179.638 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.9 96.26 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.304 -0.872 . . . . 0.15 108.696 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.51 HD11 ' CE2' ' A' ' 11' ' ' PHE . 65.4 mt -59.92 -40.25 88.23 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.219 -0.926 . . . . 0.17 108.597 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -69.39 -36.33 76.68 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.181 -0.95 . . . . 1.07 110.009 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.6 -39.31 84.8 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.343 -0.848 . . . . 0.18 110.516 -178.887 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -32.45 70.96 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.228 -0.92 . . . . 0.17 108.966 -179.874 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.55 -124.02 17.59 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.968 -1.253 . . . . 0.2 109.968 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -93.43 5.31 52.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.32 -1.106 . . . . 1.07 110.505 -179.073 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -76.55 149.28 36.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.157 -0.964 . . . . 1.5 109.173 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.682 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -60.31 157.73 13.05 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 106.861 -1.533 . . . . 0.47 106.861 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.663 ' H ' HD23 ' A' ' 22' ' ' LEU . 99.5 t -143.95 112.39 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.049 -1.032 . . . . 0.17 108.685 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -100.17 144.68 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 108.443 -0.947 . . . . 0.14 108.443 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.416 ' CG1' HG21 ' A' ' 57' ' ' VAL . 21.4 t -126.4 121.09 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 O-C-N 121.273 -0.892 . . . . 0.13 109.796 -179.917 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.0 t70 -98.66 120.08 38.49 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.217 -0.927 . . . . 1.05 109.872 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -96.3 23.27 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.342 -0.849 . . . . 0.73 110.059 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.469 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.3 m -58.67 147.36 33.06 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.054 -1.029 . . . . 0.3 110.746 -178.788 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.555 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.76 125.57 32.68 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 107.94 -1.133 . . . . 0.22 107.94 178.669 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 30' ' ' THR . . . . . 0.401 HG22 ' OD1' ' A' ' 58' ' ' ASP . 8.9 t -67.98 -33.91 75.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 118.957 -1.097 . . . . 0.3 108.573 -179.887 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.555 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.0 p-90 -70.42 -23.93 62.83 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.322 -0.861 . . . . 0.26 110.387 179.396 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.46 119.83 24.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.599 -1.313 . . . . 0.26 107.486 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -64.7 -51.29 53.09 Favored Glycine 0 N--CA 1.49 2.243 0 C-N-CA 120.3 -0.952 . . . . 0.23 110.737 -178.152 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -51.8 -36.34 62.23 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 118.553 1.176 . . . . 0.31 112.504 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.469 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.46 -48.86 16.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.97 . . . . 0.24 109.883 179.918 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.6 -34.91 74.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.119 -0.988 . . . . 1.59 109.465 179.309 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -60.01 -28.95 68.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.568 -0.708 . . . . 2.1 109.955 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.547 HG22 ' O ' ' A' ' 38' ' ' ILE . 68.2 mt -83.31 -0.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.753 -0.592 . . . . 0.49 110.379 -178.939 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.66 -30.26 6.22 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 120.674 -1.266 . . . . 0.8 113.051 -179.047 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.9 Cg_exo -59.76 -42.9 41.95 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 CA-C-N 121.699 1.643 . . . . 0.28 113.333 -177.507 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -67.91 -47.87 67.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.432 -1.417 . . . . 0.37 108.561 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -59.84 -51.53 69.32 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.296 -0.878 . . . . 0.16 110.104 179.174 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -69.37 -44.42 71.57 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 121.801 -0.562 . . . . 0.32 111.092 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 61.1 m -61.39 -39.96 92.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.147 -0.971 . . . . 0.22 110.332 -179.263 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -59.59 -24.28 63.64 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.12 -0.987 . . . . 0.22 110.113 -178.801 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -51.83 -36.53 48.36 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 120.648 -1.283 . . . . 0.16 108.957 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.7 mp0 -86.14 -14.34 44.41 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.116 -0.99 . . . . 2.16 109.43 179.178 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -80.38 -34.24 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.064 -1.458 . . . . 1.78 107.064 178.049 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -124.79 64.25 1.12 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.372 -1.344 . . . . 0.25 107.372 177.767 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -61.52 -9.7 6.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.542 -0.724 . . . . 0.22 109.27 -179.271 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -91.6 9.83 30.58 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.336 -0.987 . . . . 1.13 108.336 179.216 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.52 HG13 ' HB3' ' A' ' 22' ' ' LEU . 47.8 t -127.39 142.11 44.49 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 N-CA-C 106.683 -1.599 . . . . 0.24 106.683 178.575 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -99.79 119.61 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.053 -1.029 . . . . 0.15 109.425 -178.424 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.524 ' C ' HD12 ' A' ' 55' ' ' LEU . 30.0 m-85 -99.07 124.43 44.07 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.309 -0.87 . . . . 0.12 110.293 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.524 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.7 mp -109.16 141.43 41.38 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.168 -0.958 . . . . 0.22 109.095 178.855 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -110.02 132.35 54.24 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 106.925 -1.509 . . . . 1.13 106.925 178.101 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.416 HG21 ' CG1' ' A' ' 25' ' ' VAL . 40.9 t -128.38 132.54 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.476 -0.765 . . . . 0.15 110.416 -177.894 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 27.8 t0 -95.81 119.6 34.58 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.458 -0.776 . . . . 1.05 109.044 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.59 -16.57 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.469 -1.394 . . . . 0.16 108.598 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.6 m-20 -92.11 -42.91 9.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.449 -0.782 . . . . 1.08 111.506 -178.656 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -97.32 -23.4 16.14 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.869 -1.144 . . . . 1.07 108.638 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -114.08 36.36 3.74 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.828 -1.545 . . . . 0.14 106.828 179.191 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 63' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.3 OUTLIER -59.67 -20.53 56.85 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.657 -0.702 . . . . 1.47 110.037 -178.736 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.651 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -67.13 -37.43 83.84 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.98 -1.075 . . . . 1.05 109.201 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.651 HG23 ' OD1' ' A' ' 64' ' ' ASP . 19.0 t -72.89 -43.54 59.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.212 -0.93 . . . . 0.35 109.279 179.91 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.77 -40.04 72.87 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.71 -0.619 . . . . 0.26 110.849 -178.464 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.2 p -60.98 -35.41 76.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.514 -1.366 . . . . 0.24 108.864 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.419 ' OE2' ' NZ ' ' A' ' 8' ' ' LYS . 36.9 tt0 -62.22 -39.59 93.29 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.448 -0.782 . . . . 2.06 109.401 178.796 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.74 -2.56 58.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.28 -0.887 . . . . 0.23 110.767 -179.299 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 55.57 49.16 17.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.214 -0.929 . . . . 2.02 109.133 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.1 t -62.74 131.83 28.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 C-N-CA 118.267 -1.373 . . . . 0.16 108.397 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -102.85 -12.42 17.57 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.668 -0.645 . . . . 1.6 109.828 -178.983 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.467 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.22 155.93 18.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.704 -1.247 . . . . 0.14 110.588 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -128.47 153.77 79.28 Favored Pre-proline 0 N--CA 1.5 2.071 0 N-CA-C 107.796 -1.187 . . . . 0.15 107.796 178.642 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -76.51 141.07 68.82 Favored 'Cis proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.797 -1.335 . . . . 0.16 113.331 -2.115 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.467 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.2 m -125.72 135.16 51.77 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 108.246 -1.02 . . . . 0.13 108.246 177.918 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.749 ' CD2' HD21 ' A' ' 97' ' ' LEU . 89.7 m-85 -111.21 132.48 54.29 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.801 -0.815 . . . . 0.2 108.801 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -123.35 141.86 51.55 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.134 -0.979 . . . . 0.29 108.696 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 100' ' ' THR . 90.1 m-85 -109.02 131.45 55.06 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.588 0.709 . . . . 0.14 111.19 -178.504 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -126.57 145.66 50.45 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.395 0.617 . . . . 0.15 109.511 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -147.98 130.39 15.73 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.368 -1.345 . . . . 1.68 107.368 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.3 mttt 57.45 29.45 17.02 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.223 -0.923 . . . . 1.22 108.841 -178.893 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.66 18.23 79.17 Favored Glycine 0 N--CA 1.49 2.248 0 C-N-CA 120.026 -1.083 . . . . 0.23 110.557 179.811 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -126.82 140.75 52.13 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.185 -1.185 . . . . 2.07 110.467 179.907 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -79.64 129.73 34.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.412 -0.805 . . . . 1.82 108.869 179.198 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.5 m -125.43 3.91 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.588 -0.695 . . . . 0.3 110.187 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.89 156.97 20.05 Favored Glycine 0 N--CA 1.496 2.634 0 C-N-CA 118.108 -1.996 . . . . 0.17 111.984 -179.477 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -165.99 149.62 7.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.977 -0.719 . . . . 1.93 109.719 179.11 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.432 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 17.6 p90 -164.1 160.85 22.01 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.186 -1.005 . . . . 0.14 109.404 177.447 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -126.02 160.75 29.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.647 -0.658 . . . . 0.12 109.901 -179.614 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.493 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 120.91 138.89 5.61 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 108.931 -1.668 . . . . 0.12 108.931 179.885 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.543 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -77.71 65.5 3.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.214 -1.168 . . . . 0.18 110.711 -178.889 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.2 t-20 -118.03 101.66 8.43 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.273 -1.01 . . . . 0.88 108.273 178.109 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' H ' ' HD3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.4 -33.2 72.66 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.332 -0.855 . . . . 1.06 111.3 -179.398 . . . . . . . . 3 3 . 1 . 028 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.8 -29.92 71.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.868 -1.145 . . . . 1.61 109.575 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.436 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 79.2 tttt -62.79 -33.99 76.35 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.637 -0.665 . . . . 1.45 109.392 -179.097 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.749 HD21 ' CD2' ' A' ' 77' ' ' PHE . 39.7 mt -59.86 -39.91 86.83 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.53 -0.915 . . . . 0.19 108.53 179.733 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.05 -42.44 99.72 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.428 -0.909 . . . . 2.1 110.523 -178.451 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.38 77.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.949 -1.094 . . . . 0.19 111.123 -178.412 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.4 HG21 ' CE1' ' A' ' 79' ' ' PHE . 24.5 m -65.98 -39.93 90.76 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.61 -1.306 . . . . 0.2 108.599 -179.822 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.01 -47.0 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.396 -1.335 . . . . 0.16 107.396 177.923 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.488 ' O ' HG12 ' A' ' 105' ' ' VAL . 48.9 t30 -60.74 -36.77 79.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.504 -0.924 . . . . 0.95 108.504 179.047 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.27 -39.72 82.07 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.759 -0.588 . . . . 2.21 109.878 -179.174 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.682 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.1 mt -98.33 -2.75 38.65 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.429 -0.794 . . . . 0.25 111.661 -178.632 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.499 1.978 0 O-C-N 120.535 -1.353 . . . . 1.08 109.391 -179.119 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 109.688 -0.486 . . . . 1.31 109.688 . . . . . . . . . 0 0 . 1 . 028 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.493 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.4 mm -129.88 140.19 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 121.583 -0.698 . . . . 0.15 109.463 -179.776 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 26.8 m -96.38 127.08 42.05 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 106.896 -1.52 . . . . 0.19 106.896 177.853 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.7 m -76.89 141.14 40.68 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.958 -1.089 . . . . 0.2 111.123 -178.042 . . . . . . . . 1 1 . 1 . 028 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.7 m95 -77.18 -11.87 59.87 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.009 -1.057 . . . . 0.21 109.32 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 30.3 m-20 . . . . . 0 C--N 1.301 -1.504 0 N-CA-C 108.636 -0.876 . . . . 0.49 108.636 179.583 . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 tppt? . . . . . 0 N--CA 1.495 1.818 0 N-CA-C 108.414 -0.958 . . . . 1.67 108.414 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -98.95 123.07 42.98 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.659 -0.867 . . . . 0.31 108.659 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.6 mm -100.81 114.16 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.761 -0.829 . . . . 0.19 108.761 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.496 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.0 mp0 -97.22 -0.12 47.29 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.241 -0.912 . . . . 2.25 109.751 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.22 156.28 38.21 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.812 -1.18 . . . . 0.15 111.271 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -64.67 -30.92 71.95 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.13 -1.063 . . . . 1.65 108.13 178.323 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -58.21 -49.43 77.09 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.612 -0.835 . . . . 0.23 108.863 -179.246 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -29.48 67.65 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.43 -0.794 . . . . 0.17 109.079 178.994 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.456 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.6 t80 -59.71 -44.15 93.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.202 -0.936 . . . . 0.14 109.136 -179.834 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -66.93 -42.94 84.47 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.778 -0.769 . . . . 1.31 108.932 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -64.13 -36.55 84.42 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.519 -0.738 . . . . 1.77 110.352 179.569 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.03 -42.83 79.99 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.375 -0.828 . . . . 0.15 109.061 -179.36 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.456 HD11 ' CE2' ' A' ' 11' ' ' PHE . 80.3 mt -60.86 -39.99 91.22 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -0.876 . . . . 0.17 108.662 179.612 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -69.7 -36.4 75.91 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.425 -0.797 . . . . 1.07 109.632 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.16 -36.82 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.435 -0.791 . . . . 0.18 110.269 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.03 -27.53 69.47 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.139 -0.975 . . . . 0.17 109.534 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.29 -129.47 28.74 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.861 -1.295 . . . . 0.2 109.861 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -93.09 7.53 43.8 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.284 -1.127 . . . . 1.07 110.473 -179.112 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -75.6 149.92 38.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.018 -1.051 . . . . 1.5 109.453 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.65 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.08 153.92 20.57 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 107.216 -1.402 . . . . 0.47 107.216 179.73 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.65 ' H ' HD23 ' A' ' 22' ' ' LEU . 63.8 t -143.29 117.38 3.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 121.002 -1.061 . . . . 0.17 108.531 179.954 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.36 139.27 25.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 108.055 -1.091 . . . . 0.14 108.055 179.573 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.5 t -121.68 123.16 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.401 -0.812 . . . . 0.13 108.941 -179.783 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.545 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.9 t70 -102.75 110.01 21.79 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.649 -0.657 . . . . 1.05 110.924 -179.521 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -90.1 103.79 16.43 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.748 -1.575 . . . . 0.73 106.748 176.923 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.8 m -130.02 146.97 51.72 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.705 -0.85 . . . . 0.3 108.705 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.706 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.48 121.6 28.41 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.571 -1.27 . . . . 0.22 107.571 179.259 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -65.69 -32.36 73.88 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 118.514 -1.274 . . . . 0.3 107.618 179.801 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.706 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.4 p-90 -70.27 -25.75 63.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.513 -0.742 . . . . 0.26 110.809 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.42 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 5.9 t -83.12 116.85 22.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.812 -1.18 . . . . 0.26 108.458 -179.318 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.453 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.67 -52.0 55.18 Favored Glycine 0 N--CA 1.49 2.262 0 C-N-CA 120.724 -0.75 . . . . 0.23 111.45 -178.425 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -53.23 -33.19 63.87 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 CA-C-N 118.497 1.148 . . . . 0.31 112.183 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.08 -52.76 8.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.208 -0.932 . . . . 0.24 109.865 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -60.13 -36.73 78.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.03 -1.044 . . . . 1.59 109.611 179.645 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 36.7 tpp -59.65 -28.1 66.94 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.457 -0.777 . . . . 2.1 109.914 -179.49 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.57 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.9 mt -80.22 -4.01 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.49 110.781 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.02 -29.94 6.14 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.371 -1.456 . . . . 0.8 114.47 -177.711 . . . . . . . . 3 3 . 1 . 029 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 39.5 Cg_exo -59.22 -40.55 68.04 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 CA-C-N 122.039 1.764 . . . . 0.28 113.506 -177.452 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -68.1 -47.22 68.8 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 118.295 -1.362 . . . . 0.37 108.74 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.64 -50.77 69.91 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.391 -0.818 . . . . 0.16 109.73 179.126 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -66.77 -41.33 87.9 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.602 -0.686 . . . . 0.32 110.441 -179.517 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.2 m -63.03 -37.73 88.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.236 -0.915 . . . . 0.22 110.652 -179.859 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.07 -25.72 67.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.174 -0.953 . . . . 0.22 110.285 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.6 m -51.44 -39.45 57.4 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.981 -1.075 . . . . 0.16 108.577 -179.359 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -84.48 -16.72 41.49 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.469 -0.769 . . . . 2.16 109.366 179.955 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -78.89 -36.62 41.82 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.776 -1.202 . . . . 1.78 108.179 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.96 66.17 1.04 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.008 -1.479 . . . . 0.25 107.008 177.728 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.5 p -61.78 -9.71 7.19 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.279 -0.637 . . . . 0.22 109.279 -179.105 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -89.93 9.1 29.04 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.271 -1.011 . . . . 1.13 108.271 179.044 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.8 t -127.37 144.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 107.688 -1.227 . . . . 0.24 107.688 178.739 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.3 mm -99.92 122.76 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 120.99 -1.068 . . . . 0.15 109.594 -178.152 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.605 ' C ' HD12 ' A' ' 55' ' ' LEU . 50.5 m-85 -104.21 124.87 49.89 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.175 -0.953 . . . . 0.12 110.203 -179.813 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.605 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -111.31 140.34 45.96 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.071 -1.018 . . . . 0.22 109.903 178.804 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -110.48 132.01 54.55 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.019 -1.474 . . . . 1.13 107.019 177.84 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 64.7 t -125.63 136.08 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.464 -0.772 . . . . 0.15 110.847 -177.977 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.547 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.1 t0 -97.04 118.85 34.38 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.396 -0.965 . . . . 1.05 108.396 179.332 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.6 m -68.03 -19.21 24.5 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 O-C-N 120.568 -1.333 . . . . 0.16 108.723 179.56 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.434 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 4.7 m-20 -93.68 -42.36 9.21 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.432 -0.793 . . . . 1.08 111.736 -179.232 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.426 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 52.8 m-20 -94.13 -15.77 24.38 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.574 -1.329 . . . . 1.07 108.489 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.42 4.2 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.505 -1.295 . . . . 0.14 107.505 179.228 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -59.95 -20.21 56.26 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.376 -0.602 . . . . 1.47 109.376 -178.982 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.679 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -63.94 -39.12 93.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.153 -0.967 . . . . 1.05 109.156 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.679 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.8 t -73.39 -43.22 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.196 -0.94 . . . . 0.35 108.992 179.634 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.57 -40.05 80.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.528 -0.733 . . . . 0.26 110.935 -178.658 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.5 p -60.07 -37.6 80.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.797 -1.189 . . . . 0.24 108.556 -179.75 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.93 -36.1 82.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.502 -0.749 . . . . 2.06 109.143 178.8 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.94 -2.18 58.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.293 -0.879 . . . . 0.23 111.217 -178.858 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 52.72 49.95 19.19 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.775 -1.203 . . . . 2.02 109.776 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.3 t -64.94 131.99 30.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 C-N-CA 118.826 -1.15 . . . . 0.16 108.534 -179.413 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -104.29 -12.78 16.43 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.694 -0.629 . . . . 1.6 109.73 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.63 155.8 17.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.996 -1.065 . . . . 0.14 110.526 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.0 154.25 81.18 Favored Pre-proline 0 N--CA 1.501 2.112 0 N-CA-C 108.065 -1.087 . . . . 0.15 108.065 178.582 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -76.0 143.92 78.16 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.987 -1.255 . . . . 0.16 112.852 -2.857 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.6 m -128.68 135.9 49.9 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 108.493 -0.929 . . . . 0.13 108.493 178.828 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.818 ' CD2' HD21 ' A' ' 97' ' ' LEU . 87.5 m-85 -108.25 129.7 55.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.2 109.187 -179.075 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.3 136.17 54.86 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.164 -1.05 . . . . 0.29 108.164 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -104.57 134.83 47.09 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.417 0.627 . . . . 0.14 110.363 -179.025 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.93 148.95 48.1 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.621 0.724 . . . . 0.15 109.3 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -146.54 122.97 11.02 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.049 -1.463 . . . . 1.68 107.049 179.679 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 74.4 mttt 58.05 27.27 14.63 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.904 -1.147 . . . . 1.22 107.904 -178.403 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.49 11.04 84.58 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.515 -1.034 . . . . 0.23 110.515 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -112.63 134.52 54.11 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.413 -1.051 . . . . 2.07 109.919 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -79.31 123.91 27.9 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.996 -1.113 . . . . 1.82 107.996 178.861 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.4 m -124.79 12.12 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.809 -0.557 . . . . 0.3 110.452 -179.197 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.41 152.44 11.07 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 118.685 -1.721 . . . . 0.17 111.496 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -167.26 148.89 5.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.723 -0.869 . . . . 1.93 109.87 179.254 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.685 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 21.9 p90 -164.02 162.59 23.25 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 119.652 -0.819 . . . . 0.14 109.127 177.209 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -125.38 160.51 29.2 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 121.609 0.719 . . . . 0.12 110.329 -179.014 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.486 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 118.61 140.06 6.27 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.47 -1.452 . . . . 0.12 109.47 179.684 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.29 66.95 3.99 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.372 -1.075 . . . . 0.18 111.042 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -116.98 96.88 5.66 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 106.919 -1.512 . . . . 0.88 106.919 177.861 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -37.49 77.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.565 -0.709 . . . . 1.06 112.705 -177.783 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -63.08 -28.86 70.37 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.888 -1.133 . . . . 1.61 109.572 -179.768 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.685 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 21.0 ttpp -63.93 -33.76 76.44 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.584 -0.698 . . . . 1.45 109.682 -179.032 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.818 HD21 ' CD2' ' A' ' 77' ' ' PHE . 34.2 mt -57.96 -38.91 76.89 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.985 -1.117 . . . . 0.19 107.985 179.036 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -60.47 -42.13 95.61 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 115.629 -0.714 . . . . 2.1 110.014 -178.673 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.08 77.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.182 -0.948 . . . . 0.19 110.958 -179.239 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.34 -39.89 89.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.924 -1.11 . . . . 0.2 109.309 -179.158 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.5 mt -60.91 -49.65 83.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 107.758 -1.201 . . . . 0.16 107.758 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.474 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.0 t-20 -60.06 -35.42 75.1 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.806 0.813 . . . . 0.95 109.024 178.934 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -67.57 -40.0 84.88 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.523 -0.735 . . . . 2.21 109.986 -178.407 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.563 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.3 mt -100.16 1.08 41.71 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.224 -0.923 . . . . 0.25 111.605 -178.756 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.468 -1.395 . . . . 1.08 109.87 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp . . . . . 0 N--CA 1.493 1.719 0 N-CA-C 109.609 -0.515 . . . . 1.31 109.609 . . . . . . . . . 0 0 . 1 . 029 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.486 HD11 ' HA2' ' A' ' 91' ' ' GLY . 24.2 mm -129.96 140.49 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 O-C-N 121.765 -0.584 . . . . 0.15 110.065 -179.059 . . . . . . . . 2 2 . 1 . 029 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.9 m -93.24 128.1 39.09 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.309 -1.367 . . . . 0.19 107.309 177.431 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -80.28 137.13 36.56 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.043 -1.036 . . . . 0.2 111.211 -178.287 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -73.59 -10.31 59.58 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.091 -1.006 . . . . 0.21 109.309 179.001 . . . . . . . . 1 1 . 1 . 029 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 24.9 m-20 . . . . . 0 C--N 1.299 -1.6 0 O-C-N 121.596 -0.69 . . . . 0.49 109.355 179.666 . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.9 tptp . . . . . 0 N--CA 1.5 2.069 0 N-CA-C 108.174 -1.047 . . . . 1.67 108.174 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' A' A ' 4' ' ' GLN . . . . . 0.467 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 64.4 tt0 -97.77 122.87 41.38 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.717 -0.846 . . . . 0.31 108.717 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -101.3 114.49 40.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 N-CA-C 107.823 -1.177 . . . . 0.19 107.823 179.432 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.467 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 79.9 mm-40 -97.88 0.07 45.95 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.751 -1.218 . . . . 2.25 110.098 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.0 p -154.19 157.75 39.28 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.087 -1.008 . . . . 0.15 110.951 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.14 -33.91 76.49 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.313 -0.995 . . . . 1.65 108.313 178.487 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.1 m -56.37 -47.95 77.85 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.626 -0.83 . . . . 0.23 109.066 -178.776 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.34 -29.58 68.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.199 -0.938 . . . . 0.17 109.28 178.517 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.566 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.5 t80 -59.66 -46.03 90.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.93 -1.106 . . . . 0.14 109.22 -179.315 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -65.52 -42.93 91.5 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.067 -0.716 . . . . 1.31 109.067 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -64.34 -36.09 82.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.719 -0.613 . . . . 1.77 109.819 179.57 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.92 -43.29 79.54 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.407 -0.808 . . . . 0.15 109.538 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.566 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.9 mt -61.4 -40.0 92.78 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.176 -0.953 . . . . 0.17 108.698 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -69.28 -38.38 78.32 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.658 0.742 . . . . 1.07 109.336 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.29 -35.48 76.07 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.488 0.661 . . . . 0.18 109.909 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.2 -22.19 64.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 0.17 110.462 -178.926 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -140.99 37.07 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.006 -1.568 . . . . 0.2 109.71 179.741 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.83 5.16 49.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.379 -1.071 . . . . 1.07 110.688 -179.11 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.0 mttm -74.06 152.29 39.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.878 -1.138 . . . . 1.5 109.676 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.673 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.01 154.76 18.33 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 108.197 -1.038 . . . . 0.47 108.197 -179.37 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.649 ' H ' HD23 ' A' ' 22' ' ' LEU . 58.2 t -142.56 113.41 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.987 -1.071 . . . . 0.17 109.358 -179.693 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.45 142.57 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 108.087 -1.079 . . . . 0.14 108.087 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.0 t -125.51 123.16 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.453 -0.779 . . . . 0.13 109.553 -178.992 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.517 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 35.5 t70 -98.99 119.54 37.94 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 1.05 109.953 179.588 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -96.63 25.82 4.89 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.237 -0.914 . . . . 0.73 109.577 179.433 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.418 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.2 m -59.99 145.52 45.9 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.146 -0.971 . . . . 0.3 110.23 -178.731 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.713 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.98 124.21 30.81 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.919 -1.141 . . . . 0.22 107.919 179.189 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.1 t -68.24 -29.0 67.71 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 119.29 -0.964 . . . . 0.3 108.585 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.713 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 70.3 p-90 -76.42 -13.74 60.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.023 -1.048 . . . . 0.26 109.881 179.855 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.6 t -90.27 115.64 27.64 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.26 108.596 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.422 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.94 -53.99 40.58 Favored Glycine 0 N--CA 1.489 2.23 0 C-N-CA 120.41 -0.9 . . . . 0.23 111.33 -178.798 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -50.35 -35.55 44.81 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 CA-C-N 118.768 1.284 . . . . 0.31 112.096 -179.835 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.418 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.21 -47.16 18.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 0.24 110.008 -179.545 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.93 -32.21 70.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.176 -0.953 . . . . 1.59 109.348 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.502 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.83 -29.19 68.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.551 -0.718 . . . . 2.1 110.243 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.559 HD11 ' HB1' ' A' ' 92' ' ' ALA . 21.4 mt -80.99 -4.41 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.655 -0.653 . . . . 0.49 111.069 -179.036 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.01 -31.76 10.16 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 120.138 -1.601 . . . . 0.8 113.211 -177.409 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.76 -36.38 91.57 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 121.573 1.597 . . . . 0.28 112.162 -178.421 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -72.37 -51.81 18.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 118.953 -1.099 . . . . 0.37 108.498 179.588 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.81 -47.23 86.53 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.391 -0.818 . . . . 0.16 109.056 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -68.36 -43.03 78.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.557 -0.715 . . . . 0.32 110.877 179.667 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.8 m -64.03 -38.23 90.3 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.954 -1.091 . . . . 0.22 110.679 -179.306 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.92 -23.92 66.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.396 -0.815 . . . . 0.22 110.735 -178.376 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.2 m -54.26 -38.05 65.37 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.793 -1.192 . . . . 0.16 108.397 -179.426 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.63 -17.87 40.07 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.283 -0.886 . . . . 2.16 109.256 178.948 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -76.34 -36.82 58.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.749 -1.219 . . . . 1.78 108.004 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -123.53 65.69 1.01 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 106.58 -1.637 . . . . 0.25 106.58 178.108 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -62.41 -9.78 9.42 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.53 -0.915 . . . . 0.22 108.53 -179.396 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -89.37 8.9 28.31 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.787 -1.19 . . . . 1.13 107.787 178.727 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.428 HG13 ' HB3' ' A' ' 22' ' ' LEU . 58.4 t -127.87 145.16 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 N-CA-C 108.161 -1.052 . . . . 0.24 108.161 179.152 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.01 122.47 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.065 -1.022 . . . . 0.15 109.249 -179.12 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.602 ' C ' HD12 ' A' ' 55' ' ' LEU . 33.4 m-85 -103.68 129.31 50.99 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.169 -0.957 . . . . 0.12 109.521 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.602 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -111.94 142.37 44.43 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.126 -0.984 . . . . 0.22 109.985 179.168 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 107.016 -1.476 . . . . 1.13 107.016 177.732 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.7 t -128.86 134.38 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.477 -0.765 . . . . 0.15 110.748 -177.888 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.573 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.9 t0 -95.19 119.8 34.32 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.485 -0.759 . . . . 1.05 109.232 179.614 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.91 -16.68 21.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.575 -1.328 . . . . 0.16 108.306 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.545 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.1 m-20 -94.1 -44.12 8.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.439 -0.788 . . . . 1.08 111.696 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 61' ' ' ASP . . . . . 0.456 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 68.7 m-20 -95.81 -14.36 23.33 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.728 -1.232 . . . . 1.07 108.654 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.03 38.23 4.24 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 107.364 -1.347 . . . . 0.14 107.364 179.27 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -59.94 -23.17 63.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.758 -0.589 . . . . 1.47 110.065 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.579 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.7 p30 -65.94 -37.58 86.4 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.042 -1.036 . . . . 1.05 108.9 179.171 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.579 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.8 t -71.34 -44.1 72.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.263 -0.898 . . . . 0.35 109.548 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.09 70.57 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.442 -0.786 . . . . 0.26 111.14 -178.449 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.0 p -60.06 -32.88 71.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.084 -1.01 . . . . 0.24 109.157 -179.243 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -60.66 -38.33 84.53 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.958 -0.756 . . . . 2.06 108.958 179.176 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.02 1.4 57.22 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.438 -0.789 . . . . 0.23 110.809 -179.251 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 54.89 50.51 15.45 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.025 -1.047 . . . . 2.02 109.306 -179.328 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 133.1 30.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 118.324 -1.35 . . . . 0.16 107.959 -179.283 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -105.79 -10.99 16.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 1.6 109.917 -179.121 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.49 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -161.27 156.04 23.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.848 -1.157 . . . . 0.14 111.214 -179.654 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 154.36 81.04 Favored Pre-proline 0 N--CA 1.503 2.204 0 N-CA-C 108.263 -1.014 . . . . 0.15 108.263 179.059 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -76.42 141.63 70.69 Favored 'Cis proline' 0 N--CA 1.495 1.588 0 C-N-CA 123.929 -1.28 . . . . 0.16 112.799 -2.505 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -127.47 132.54 49.99 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.648 0.737 . . . . 0.13 109.39 178.832 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.814 ' CD2' HD21 ' A' ' 97' ' ' LEU . 88.7 m-85 -108.52 131.75 54.51 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.011 -0.737 . . . . 0.2 109.011 179.979 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -120.72 143.04 48.98 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.395 -0.965 . . . . 0.29 108.395 179.121 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' HG21 ' A' ' 100' ' ' THR . 75.0 m-85 -109.0 133.49 52.91 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 121.708 0.766 . . . . 0.14 110.449 -179.249 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -128.83 143.6 50.95 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 109.383 -0.599 . . . . 0.15 109.383 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -146.37 125.93 13.3 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.71 -1.589 . . . . 1.68 106.71 178.807 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 58.29 29.42 18.05 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.559 -0.904 . . . . 1.22 108.559 -178.466 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.7 11.73 85.16 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.744 -1.342 . . . . 0.23 109.744 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -111.43 132.39 54.5 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.509 -0.994 . . . . 2.07 109.989 -179.053 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -78.41 121.01 23.95 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.048 -1.093 . . . . 1.82 108.048 178.538 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -123.99 11.47 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.777 -0.577 . . . . 0.3 110.627 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -174.2 151.42 12.87 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 118.175 -1.964 . . . . 0.17 112.137 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 3.8 tp10 -163.75 140.22 6.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.923 -0.751 . . . . 1.93 109.218 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.466 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 3.9 p90 -163.87 156.86 18.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.568 -0.707 . . . . 0.14 109.246 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.71 160.25 31.34 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.596 -0.69 . . . . 0.12 110.064 -179.337 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.499 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.85 139.43 5.26 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.347 -1.501 . . . . 0.12 109.347 179.465 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.559 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.54 63.45 2.06 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.353 -1.086 . . . . 0.18 109.68 -179.839 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -118.76 102.25 8.68 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.732 -0.84 . . . . 0.88 108.732 178.557 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.7 -36.25 75.77 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.338 -0.851 . . . . 1.06 111.613 -179.846 . . . . . . . . 3 3 . 1 . 030 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.2 -29.41 69.8 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.844 -1.16 . . . . 1.61 109.472 -179.822 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.489 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 50.5 tttp -60.98 -36.11 78.57 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.591 -0.693 . . . . 1.45 109.205 -179.242 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.814 HD21 ' CD2' ' A' ' 77' ' ' PHE . 45.1 mt -59.05 -39.93 83.56 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-O 122.1 0.952 . . . . 0.19 108.924 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -63.02 -41.58 99.58 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.074 -0.65 . . . . 2.1 111.077 -178.115 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.03 -43.25 79.19 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.059 -1.026 . . . . 0.19 111.526 -178.293 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 100' ' ' THR . . . . . 0.417 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.7 m -66.75 -39.94 88.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.858 -1.151 . . . . 0.2 109.892 -178.332 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.93 -48.97 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.237 -1.023 . . . . 0.16 108.237 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.454 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.7 t-20 -60.16 -35.63 75.74 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.998 0.904 . . . . 0.95 108.675 178.616 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.54 -39.79 85.02 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.994 -0.548 . . . . 2.21 109.956 -177.976 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.673 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.5 mt -99.79 -1.64 37.13 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.258 -0.901 . . . . 0.25 111.189 -179.173 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.454 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.401 -1.437 . . . . 1.08 109.12 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 120.817 0.342 . . . . 1.31 110.373 . . . . . . . . . 0 0 . 1 . 030 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.499 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.5 mm -132.78 142.77 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.523 -0.735 . . . . 0.15 109.149 -179.814 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -103.88 125.86 50.6 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 106.803 -1.554 . . . . 0.19 106.803 177.431 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -79.33 143.85 34.77 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.849 -1.157 . . . . 0.2 111.227 -178.1 . . . . . . . . 1 1 . 1 . 030 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.49 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.3 m95 -75.91 -10.56 59.52 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.229 -0.919 . . . . 0.21 108.718 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 14.5 m-20 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 108.589 -0.893 . . . . 0.49 108.589 -179.914 . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.4 tptp . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 109.065 -0.717 . . . . 1.67 109.065 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -97.03 123.2 40.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.512 -0.742 . . . . 0.31 109.176 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.34 115.53 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.204 -0.935 . . . . 0.19 108.674 178.712 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -98.15 -0.42 44.33 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 2.25 109.344 179.518 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.57 155.6 35.07 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.672 -1.267 . . . . 0.15 111.944 -179.634 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.23 -33.16 74.06 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.138 -1.06 . . . . 1.65 108.138 178.389 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 80.3 m -58.12 -47.83 82.07 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.406 -0.809 . . . . 0.23 109.329 -179.473 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.74 -30.71 68.38 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.154 -0.966 . . . . 0.17 108.623 178.843 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.492 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.1 t80 -59.57 -43.77 93.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.146 -0.971 . . . . 0.14 108.849 -179.372 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -64.24 -43.31 95.32 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.123 -0.695 . . . . 1.31 109.123 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 13' ' ' GLU . . . . . 0.557 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -64.4 -39.34 93.66 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.505 -0.747 . . . . 1.77 110.353 179.957 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.85 -41.22 91.97 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.426 -0.796 . . . . 0.15 108.95 -179.301 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.492 HD11 ' CE2' ' A' ' 11' ' ' PHE . 51.6 mt -62.15 -39.99 94.46 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.911 -1.118 . . . . 0.17 108.809 179.414 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.86 -34.8 74.09 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.424 -0.797 . . . . 1.07 109.95 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.45 -36.77 76.93 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.326 -0.859 . . . . 0.18 110.212 -179.606 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.54 80.59 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.229 -0.919 . . . . 0.17 109.373 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.32 -124.58 22.59 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.656 -1.377 . . . . 0.2 109.656 -179.415 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -89.98 2.07 55.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.11 -1.229 . . . . 1.07 110.592 -178.797 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -74.61 150.22 39.74 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.829 -1.169 . . . . 1.5 109.697 -179.933 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.685 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -61.34 156.24 19.41 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.075 -1.454 . . . . 0.47 107.075 179.741 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.599 ' H ' HD23 ' A' ' 22' ' ' LEU . 78.7 t -143.46 112.69 2.03 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 120.991 -1.068 . . . . 0.17 108.94 -179.532 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -103.0 138.85 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 108.498 -0.927 . . . . 0.14 108.498 179.776 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.1 t -122.08 119.66 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.488 -0.757 . . . . 0.13 109.16 -179.441 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.571 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.5 t70 -98.99 109.09 21.9 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.525 -0.735 . . . . 1.05 110.344 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -89.95 102.81 15.52 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 106.754 -1.573 . . . . 0.73 106.754 177.548 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.0 m -129.01 146.56 50.95 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.794 -0.817 . . . . 0.3 108.794 -179.743 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.552 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.73 122.67 30.15 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.777 -1.194 . . . . 0.22 107.777 179.104 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -65.72 -34.09 77.38 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 118.92 -1.112 . . . . 0.3 108.724 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.552 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 46.2 p-90 -70.73 -23.56 62.46 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.366 -0.833 . . . . 0.26 110.634 179.797 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -84.2 112.97 20.75 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.621 -1.251 . . . . 0.26 107.621 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.494 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.61 -49.16 81.53 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 120.415 -0.898 . . . . 0.23 111.086 -178.298 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.6 Cg_exo -53.46 -35.38 75.77 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 CA-C-N 118.616 1.208 . . . . 0.31 112.704 179.913 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.97 -55.77 5.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.228 -0.92 . . . . 0.24 109.928 -179.682 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -59.82 -37.43 79.17 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.144 -0.973 . . . . 1.59 109.421 -179.837 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.401 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 37.6 ttm -59.69 -28.95 67.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.995 . . . . 2.1 109.994 -179.618 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.586 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -80.05 -4.5 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.725 -0.609 . . . . 0.49 110.926 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -65.39 -26.11 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 120.382 -1.449 . . . . 0.8 114.604 -177.548 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.6 Cg_exo -57.56 -37.99 95.25 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 CA-C-N 122.536 1.941 . . . . 0.28 113.148 -176.648 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -69.88 -43.31 72.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.049 -1.46 . . . . 0.37 108.478 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -63.65 -50.57 68.76 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.001 0.905 . . . . 0.16 109.788 179.208 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -68.01 -44.03 77.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 121.237 0.541 . . . . 0.32 109.691 179.701 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.1 m -60.71 -37.15 80.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.983 -1.073 . . . . 0.22 110.498 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -63.48 -22.3 66.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.705 -1.247 . . . . 0.22 110.833 -178.527 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -53.71 -37.4 63.26 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.967 -1.083 . . . . 0.16 108.279 -179.252 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 54.7 mp0 -85.65 -17.73 35.24 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.066 -1.021 . . . . 2.16 109.47 179.708 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.28 -35.71 54.87 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.754 -1.202 . . . . 1.78 107.754 179.228 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -124.94 66.57 1.11 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 106.906 -1.516 . . . . 0.25 106.906 178.025 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -64.2 -7.96 10.88 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.829 -0.804 . . . . 0.22 108.829 -179.129 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -91.09 10.16 27.97 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 108.458 -0.941 . . . . 1.13 108.458 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.401 HG13 ' HB3' ' A' ' 22' ' ' LEU . 44.7 t -128.03 149.92 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 N-CA-C 107.996 -1.113 . . . . 0.24 107.996 179.392 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.0 mm -100.72 122.19 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.791 -1.193 . . . . 0.15 109.044 -178.839 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.623 ' C ' HD12 ' A' ' 55' ' ' LEU . 63.6 m-85 -106.95 128.88 54.72 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.071 -1.018 . . . . 0.12 109.33 179.753 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.623 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -114.95 142.25 46.87 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.924 -1.11 . . . . 0.22 109.5 179.183 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -111.77 130.13 55.9 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 106.753 -1.573 . . . . 1.13 106.753 177.703 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -126.39 137.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.267 -0.896 . . . . 0.15 111.741 -177.571 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.2 t0 -99.1 119.56 38.04 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.702 -0.851 . . . . 1.05 108.702 179.14 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -70.33 -16.95 20.4 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 O-C-N 120.946 -1.096 . . . . 0.16 108.918 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 4.3 m-20 -95.2 -39.6 10.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 1.08 111.547 -179.376 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -96.24 -17.96 20.38 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 120.832 -1.167 . . . . 1.07 108.216 179.453 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.92 41.2 3.57 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.477 -1.305 . . . . 0.14 107.477 179.031 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.43 -25.67 66.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.831 -0.543 . . . . 1.47 109.697 -178.747 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.614 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -62.97 -38.68 92.08 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.912 -1.118 . . . . 1.05 109.162 179.241 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.614 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -70.51 -44.27 77.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 121.193 -0.942 . . . . 0.35 109.868 -179.843 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.01 -37.31 69.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.364 -0.835 . . . . 0.26 111.255 -178.879 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.0 p -60.27 -33.96 73.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.793 -1.192 . . . . 0.24 109.381 -178.865 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.67 -36.57 84.28 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.576 -0.702 . . . . 2.06 109.801 179.615 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.88 -1.95 58.35 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.426 -0.797 . . . . 0.23 111.302 -178.781 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 56.94 48.8 15.14 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.033 -1.042 . . . . 2.02 109.578 -179.288 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.0 t -64.39 129.78 28.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 120.809 -1.182 . . . . 0.16 108.056 -179.828 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -103.04 -11.77 17.9 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.718 -0.613 . . . . 1.6 109.982 -179.387 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.508 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.68 154.24 17.97 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.801 -1.187 . . . . 0.14 110.377 179.767 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.408 HG23 ' NE1' ' B' ' 67' ' ' TRP . 33.0 p -130.12 155.55 80.58 Favored Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.146 -0.971 . . . . 0.15 108.767 179.039 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -73.56 144.67 81.74 Favored 'Cis proline' 0 N--CA 1.493 1.495 0 C-N-CA 123.934 -1.277 . . . . 0.16 112.999 -2.586 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.4 m -130.1 134.7 47.53 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.033 -1.099 . . . . 0.13 108.033 178.69 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.571 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -109.88 131.25 55.23 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.426 -0.796 . . . . 0.2 109.129 -179.14 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -124.3 140.43 52.97 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.289 -1.004 . . . . 0.29 108.289 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -108.29 135.85 48.91 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 121.436 0.636 . . . . 0.14 110.232 -179.32 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.02 146.53 50.32 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.669 -0.863 . . . . 0.15 108.669 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -143.4 121.64 12.25 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.759 -1.2 . . . . 1.68 107.759 -179.843 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 60.03 27.35 16.76 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.596 -0.69 . . . . 1.22 109.857 -179.427 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.24 Favored Glycine 0 N--CA 1.495 2.623 0 O-C-N 120.899 -1.126 . . . . 0.23 110.994 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -127.05 142.2 51.59 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.049 -1.265 . . . . 2.07 110.172 -179.781 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 85' ' ' LYS . . . . . 0.457 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 33.1 ttpt -79.6 126.75 31.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.243 -0.911 . . . . 1.82 108.977 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.5 m -119.98 11.55 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.647 -0.658 . . . . 0.3 110.683 -179.21 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 165.03 157.31 9.61 Favored Glycine 0 N--CA 1.492 2.403 0 C-N-CA 118.501 -1.809 . . . . 0.17 111.492 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 12.3 pt-20 -165.97 158.11 14.45 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.775 -0.838 . . . . 1.93 109.794 179.231 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -164.09 163.26 23.21 Favored 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 119.27 -0.972 . . . . 0.14 109.976 176.844 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.26 160.73 29.51 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 121.633 0.73 . . . . 0.12 110.175 -179.357 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.527 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 116.58 141.77 7.2 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 108.776 -1.729 . . . . 0.12 108.776 -179.873 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.1 68.5 4.15 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.315 -1.109 . . . . 0.18 111.489 -178.84 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.447 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -117.84 100.4 7.56 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 108.289 -1.004 . . . . 0.88 108.289 177.871 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.469 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.03 -33.27 73.35 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.173 -0.954 . . . . 1.06 111.619 -179.263 . . . . . . . . 3 3 . 1 . 031 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.86 -29.06 69.45 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.621 -1.3 . . . . 1.61 110.063 -179.225 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.447 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 43.3 tttp -60.93 -34.31 74.51 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.509 -0.923 . . . . 1.45 108.509 -179.086 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.417 HD21 ' CD1' ' A' ' 77' ' ' PHE . 43.3 mt -60.13 -40.05 88.43 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.714 0.768 . . . . 0.19 109.008 179.777 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.32 -41.89 98.92 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.988 -0.685 . . . . 2.1 110.836 -177.827 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.94 -43.96 70.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.19 111.454 -178.514 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.6 m -65.3 -39.99 93.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.088 -1.007 . . . . 0.2 109.883 -178.76 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 101' ' ' ILE . . . . . 0.402 ' O ' ' N ' ' A' ' 105' ' ' VAL . 63.9 mt -61.52 -48.54 88.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 108.002 -1.11 . . . . 0.16 108.002 179.235 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.9 t-20 -60.2 -36.36 77.48 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.409 -0.96 . . . . 0.95 108.409 178.727 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.59 85.75 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.637 -0.505 . . . . 2.21 109.637 -178.984 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.685 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.9 mt -99.86 -3.15 33.15 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.126 -0.984 . . . . 0.25 111.626 -179.042 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.46 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.397 -1.439 . . . . 1.08 109.119 -179.518 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm . . . . . 0 N--CA 1.488 1.428 0 N-CA-C 110.228 -0.286 . . . . 1.31 110.228 . . . . . . . . . 0 0 . 1 . 031 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.527 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.3 mm -129.92 146.99 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 109.543 -0.539 . . . . 0.15 109.543 -179.968 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 60.9 m -104.59 126.27 51.52 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 107.176 -1.416 . . . . 0.19 107.176 177.848 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.0 m -77.46 138.18 39.09 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.672 -1.267 . . . . 0.2 111.016 -178.567 . . . . . . . . 1 1 . 1 . 031 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.408 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.8 m95 -75.05 -9.63 58.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.012 -1.055 . . . . 0.21 109.556 179.056 . . . . . . . . 2 2 . 1 . 031 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 35.8 m-20 . . . . . 0 C--N 1.3 -1.55 0 O-C-N 121.335 -0.853 . . . . 0.49 109.122 -179.891 . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 tptm . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 108.238 -1.023 . . . . 1.67 108.238 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -98.13 124.52 42.71 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.21 -0.931 . . . . 0.31 108.96 179.566 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.2 mm -100.92 113.83 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.389 -0.819 . . . . 0.19 108.824 179.165 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -98.47 -0.38 43.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.318 -0.864 . . . . 2.25 109.395 179.077 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -154.33 155.7 35.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.971 -1.081 . . . . 0.15 111.324 179.587 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -62.66 -30.92 71.74 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.247 -1.02 . . . . 1.65 108.247 178.478 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.1 m -59.02 -48.7 80.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.35 -0.94 . . . . 0.23 108.701 -179.573 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.14 -28.8 67.62 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.85 -0.74 . . . . 0.17 109.067 179.079 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.478 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.0 t80 -59.89 -43.84 94.55 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.097 -1.002 . . . . 0.14 108.568 -179.683 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.89 -42.17 85.97 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.312 -0.625 . . . . 1.31 109.312 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.8 -37.14 86.6 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.43 0.633 . . . . 1.77 110.046 -179.814 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.06 80.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.289 -0.882 . . . . 0.15 108.999 -179.696 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.478 HD11 ' CE2' ' A' ' 11' ' ' PHE . 71.2 mt -61.02 -39.84 91.3 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.108 -0.995 . . . . 0.17 108.917 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.65 -35.27 75.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.532 -0.73 . . . . 1.07 110.2 -179.629 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.05 -37.5 75.57 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.341 -0.849 . . . . 0.18 110.801 -178.952 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.11 72.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.098 -1.002 . . . . 0.17 109.757 -179.503 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.22 20.23 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 110.24 -1.144 . . . . 0.2 110.24 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 20' ' ' ASP . . . . . 0.402 ' OD1' ' NZ ' ' A' ' 82' ' ' LYS . 70.7 m-20 -90.7 1.76 56.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.157 -1.201 . . . . 1.07 110.554 -178.48 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -75.73 150.12 37.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.014 -1.054 . . . . 1.5 110.251 -178.807 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.693 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.93 154.26 22.81 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 107.605 -1.257 . . . . 0.47 107.605 -179.665 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.693 ' H ' HD23 ' A' ' 22' ' ' LEU . 90.4 t -144.41 116.13 2.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.057 -1.027 . . . . 0.17 108.646 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.2 t -105.08 142.6 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 107.959 -1.126 . . . . 0.14 107.959 179.497 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 25' ' ' VAL . . . . . 0.4 ' CG1' HG21 ' A' ' 57' ' ' VAL . 21.7 t -125.31 123.17 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 O-C-N 121.179 -0.951 . . . . 0.13 109.514 -179.233 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.558 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 32.8 t70 -100.64 120.07 39.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.343 -0.848 . . . . 1.05 110.427 179.303 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -97.29 25.58 5.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.335 -0.853 . . . . 0.73 110.336 179.315 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.3 m -59.47 146.62 39.63 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.923 -1.111 . . . . 0.3 110.061 -178.662 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.588 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.15 126.84 33.04 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.699 -1.223 . . . . 0.22 107.699 179.34 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 t -68.06 -34.92 77.34 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.148 -1.021 . . . . 0.3 108.365 -179.841 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.588 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.8 p-90 -69.86 -22.34 63.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.43 -0.794 . . . . 0.26 110.539 179.576 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.7 t -85.11 106.49 16.61 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.526 -1.287 . . . . 0.26 107.526 179.695 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.518 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.83 -46.85 92.92 Favored Glycine 0 N--CA 1.487 2.08 0 C-N-CA 120.363 -0.922 . . . . 0.23 111.084 -178.469 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -52.35 -36.21 67.82 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.942 1.371 . . . . 0.31 111.663 179.682 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.16 -49.4 13.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.493 -0.754 . . . . 0.24 109.954 179.98 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -59.9 -31.55 69.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.232 -0.918 . . . . 1.59 109.276 179.894 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.519 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -59.91 -29.79 68.6 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.252 -0.905 . . . . 2.1 109.587 -179.465 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 mt -81.55 -8.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.532 -0.73 . . . . 0.49 111.34 -179.186 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.517 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.5 ptmt -61.67 -28.38 3.95 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 120.27 -1.519 . . . . 0.8 113.621 -177.253 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.9 Cg_exo -57.63 -37.84 95.51 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 122.696 1.999 . . . . 0.28 112.178 -176.828 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -68.57 -47.72 66.07 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.601 -1.24 . . . . 0.37 108.113 179.306 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -60.34 -52.12 66.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.669 -0.644 . . . . 0.16 109.674 178.752 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -68.2 -40.28 82.2 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.478 -0.764 . . . . 0.32 110.836 -179.724 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.42 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.9 m -62.81 -39.08 93.18 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.952 -1.093 . . . . 0.22 110.666 -179.802 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.5 mt -63.18 -23.9 67.64 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.163 -0.961 . . . . 0.22 111.044 -178.383 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -53.33 -36.78 61.66 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 120.712 -1.243 . . . . 0.16 108.699 -179.18 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.2 mp0 -87.24 -14.02 42.2 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.267 -0.896 . . . . 2.16 109.179 179.395 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.29 -38.07 36.23 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.152 -1.425 . . . . 1.78 107.152 178.908 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.74 68.28 0.91 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 106.856 -1.535 . . . . 0.25 106.856 178.002 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.66 -9.07 12.0 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.748 -0.834 . . . . 0.22 108.748 -179.331 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.04 7.18 36.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.875 -1.157 . . . . 1.13 107.875 178.861 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.9 t -127.45 144.82 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 107.791 -1.189 . . . . 0.24 107.791 178.777 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.6 mm -100.02 121.05 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.027 -1.046 . . . . 0.15 109.419 -178.804 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.568 ' C ' HD12 ' A' ' 55' ' ' LEU . 35.6 m-85 -102.06 125.54 48.77 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.16 -0.963 . . . . 0.12 109.2 179.266 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.592 HD12 ' N ' ' A' ' 55' ' ' LEU . 6.7 mp -108.63 140.87 41.39 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.04 -1.038 . . . . 0.22 109.361 179.613 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -108.92 132.07 54.42 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.273 -1.751 . . . . 1.13 106.273 177.978 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 57' ' ' VAL . . . . . 0.4 HG21 ' CG1' ' A' ' 25' ' ' VAL . 42.5 t -130.72 133.61 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.295 -0.878 . . . . 0.15 110.76 -177.659 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.614 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.0 t0 -96.02 119.0 33.73 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.865 -0.791 . . . . 1.05 108.865 179.681 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.25 -16.82 21.5 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 O-C-N 120.524 -1.36 . . . . 0.16 108.784 179.319 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.54 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.3 m-20 -94.78 -40.19 9.89 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.433 -0.792 . . . . 1.08 111.623 -178.467 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -98.09 -15.46 19.97 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.826 -1.171 . . . . 1.07 107.938 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.614 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.89 38.47 4.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.621 -1.251 . . . . 0.14 107.621 179.389 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -59.88 -27.74 66.96 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.731 -0.605 . . . . 1.47 109.859 -178.608 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.548 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -64.03 -36.0 82.55 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.686 -1.259 . . . . 1.05 109.155 179.591 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.548 HG23 ' OD1' ' A' ' 64' ' ' ASP . 5.7 t -71.76 -44.06 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.309 -0.869 . . . . 0.35 109.622 179.914 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.75 69.04 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.384 -0.822 . . . . 0.26 110.287 -179.187 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -60.11 -30.47 69.28 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.197 -0.94 . . . . 0.24 108.97 -179.442 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -60.54 -39.92 89.64 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.909 -0.775 . . . . 2.06 108.909 178.881 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -91.46 0.93 57.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.28 -0.887 . . . . 0.23 110.717 -179.309 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 55.76 49.97 15.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.992 -1.068 . . . . 2.02 109.134 -178.945 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -62.8 130.51 27.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 C-N-CA 118.323 -1.351 . . . . 0.16 108.363 -178.924 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -102.22 -10.63 19.41 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.656 -0.652 . . . . 1.6 109.889 -178.933 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.47 156.09 18.24 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.698 -1.251 . . . . 0.14 111.129 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -126.79 155.66 74.93 Favored Pre-proline 0 N--CA 1.497 1.903 0 N-CA-C 107.699 -1.222 . . . . 0.15 107.699 178.309 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -76.84 140.1 63.24 Favored 'Cis proline' 0 N--CA 1.492 1.411 0 C-N-CA 123.63 -1.404 . . . . 0.16 112.271 -2.275 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.0 m -125.14 132.52 53.07 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.816 -0.809 . . . . 0.13 108.816 177.799 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.558 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.4 m-85 -110.51 131.4 55.08 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.752 -0.832 . . . . 0.2 108.752 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -122.89 139.13 54.37 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.322 -0.861 . . . . 0.29 109.11 179.465 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -105.12 136.21 45.03 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.332 0.586 . . . . 0.14 110.401 -179.392 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -129.07 146.99 50.89 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 109.258 -0.645 . . . . 0.15 109.258 179.362 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -145.93 122.67 11.21 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.615 -1.254 . . . . 1.68 107.615 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 82' ' ' LYS . . . . . 0.402 ' NZ ' ' OD1' ' A' ' 20' ' ' ASP . 55.3 mttm 56.71 34.49 24.68 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.998 -1.064 . . . . 1.22 109.043 -177.945 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.22 20.44 79.65 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 109.894 -1.282 . . . . 0.23 109.894 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 41.5 mm-40 -123.96 132.13 53.67 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.369 -1.077 . . . . 2.07 110.794 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -79.02 124.01 27.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.422 -0.799 . . . . 1.82 109.021 178.923 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.82 9.27 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.656 -0.652 . . . . 0.3 110.977 -179.634 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.85 155.43 15.53 Favored Glycine 0 N--CA 1.495 2.586 0 C-N-CA 118.244 -1.931 . . . . 0.17 111.569 -179.616 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -166.78 148.73 6.28 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.818 -0.813 . . . . 1.93 109.549 179.512 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 10.4 p90 -163.91 159.5 21.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.14 109.377 178.348 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.3 p -125.79 162.31 25.4 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.044 -0.724 . . . . 0.12 109.044 -179.525 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.448 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.11 139.78 5.67 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.586 -1.406 . . . . 0.12 109.586 179.831 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 63.6 1.93 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.453 -1.028 . . . . 0.18 110.338 -179.64 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.2 t-20 -119.12 99.93 7.02 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.531 -0.914 . . . . 0.88 108.531 178.541 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.438 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.1 OUTLIER -69.8 -31.43 69.33 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 1.06 111.597 -179.201 . . . . . . . . 3 3 . 1 . 032 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.14 -28.87 69.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.779 -1.201 . . . . 1.61 109.763 -179.589 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 96' ' ' LYS . . . . . 0.428 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 77.1 tttt -61.19 -34.97 75.92 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.655 -0.868 . . . . 1.45 108.655 -179.432 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.1 mt -59.97 -39.85 87.08 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 122.124 0.964 . . . . 0.19 108.478 179.01 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -61.18 -41.46 96.83 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.853 -0.612 . . . . 2.1 111.293 -178.115 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.36 73.0 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.851 -1.156 . . . . 0.19 112.168 -178.082 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.9 m -66.56 -39.7 88.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.73 -1.232 . . . . 0.2 110.142 -178.485 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.4 mt -60.18 -50.59 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.106 -0.996 . . . . 0.16 108.699 179.897 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.495 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.4 t30 -61.5 -33.62 74.1 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.694 -0.854 . . . . 0.95 108.694 179.189 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -68.1 -41.38 81.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 2.21 110.69 -178.956 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.624 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.4 mt -97.64 -2.14 42.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -0.925 . . . . 0.25 110.951 -178.683 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.2 p . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.624 -1.298 . . . . 1.08 109.222 -179.526 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.256 -0.646 . . . . 1.31 109.256 . . . . . . . . . 0 0 . 1 . 032 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.448 HD11 ' HA2' ' A' ' 91' ' ' GLY . 38.5 mm -128.83 140.37 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 N-CA-C 109.411 -0.589 . . . . 0.15 109.411 179.845 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.8 m -100.97 126.79 47.65 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.492 -1.299 . . . . 0.19 107.492 177.549 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.8 m -79.01 140.82 37.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.781 -1.2 . . . . 0.2 110.909 -178.512 . . . . . . . . 1 1 . 1 . 032 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.466 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.1 m95 -74.27 -10.01 59.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.898 . . . . 0.21 109.578 179.499 . . . . . . . . 2 2 . 1 . 032 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 . . . . . 0 N--CA 1.488 1.47 0 O-C-N 121.137 -0.977 . . . . 0.49 108.457 -179.869 . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.2 tttp . . . . . 0 N--CA 1.496 1.85 0 N-CA-C 108.81 -0.811 . . . . 1.67 108.81 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -97.86 126.1 43.07 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.237 -1.023 . . . . 0.31 108.237 179.464 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.4 mm -100.04 112.06 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.262 -1.014 . . . . 0.19 108.262 179.795 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -96.48 -0.38 49.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.13 -0.981 . . . . 2.25 109.727 -179.655 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -153.19 155.43 36.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.967 -1.083 . . . . 0.15 110.841 179.765 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -64.25 -33.34 75.6 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 107.981 -1.118 . . . . 1.65 107.981 178.545 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 37.1 m -57.08 -48.23 79.1 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.49 -0.93 . . . . 0.23 108.49 -179.361 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.22 -29.25 68.04 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.83 . . . . 0.17 109.125 178.942 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.472 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.4 t80 -60.04 -44.64 94.52 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -0.949 . . . . 0.14 108.731 -179.942 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -65.38 -43.57 90.29 Favored 'General case' 0 C--N 1.297 -1.704 0 C-N-CA 119.64 -0.824 . . . . 1.31 109.031 179.631 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.8 -36.34 84.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.4 -0.813 . . . . 1.77 110.282 179.383 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -43.24 79.34 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.454 -0.779 . . . . 0.15 108.975 -179.503 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.472 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.2 mt -60.37 -40.22 90.07 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.027 -1.101 . . . . 0.17 108.027 179.709 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.32 -34.64 74.95 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.281 -0.887 . . . . 1.07 109.861 179.841 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.2 -36.24 79.26 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.45 -0.781 . . . . 0.18 110.472 -179.109 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.12 -30.75 71.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.215 -0.928 . . . . 0.17 109.208 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.43 -126.44 25.1 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 109.358 -1.497 . . . . 0.2 109.358 -179.618 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -91.69 3.54 54.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.32 -1.106 . . . . 1.07 110.804 -179.273 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -74.86 149.45 39.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.663 -1.273 . . . . 1.5 108.995 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.687 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.59 160.14 5.82 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 106.992 -1.484 . . . . 0.47 106.992 179.369 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.687 ' H ' HD23 ' A' ' 22' ' ' LEU . 95.7 t -147.5 119.63 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 O-C-N 120.962 -1.086 . . . . 0.17 108.321 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.416 HG22 ' CE2' ' A' ' 79' ' ' PHE . 45.4 t -106.91 142.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 107.721 -1.214 . . . . 0.14 107.721 179.267 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.9 t -124.64 120.2 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.349 -0.844 . . . . 0.13 108.913 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 26' ' ' ASP . . . . . 0.567 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.4 t70 -98.61 108.71 21.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.331 -0.856 . . . . 1.05 111.628 -179.319 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -90.1 101.01 13.73 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.4 -1.704 . . . . 0.73 106.4 176.602 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.3 m -129.94 145.59 51.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.955 -1.128 . . . . 0.3 107.955 -179.66 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.773 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.15 122.98 29.59 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.567 -1.272 . . . . 0.22 107.567 179.474 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -63.3 -29.3 70.65 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.887 -1.153 . . . . 0.3 107.887 -179.859 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.773 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 69.6 p-90 -78.97 -10.95 59.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.475 -0.766 . . . . 0.26 111.144 -179.887 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 32' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 34.6 t -87.63 116.29 25.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.709 -1.244 . . . . 0.26 108.53 -179.674 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.467 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.47 -52.81 50.29 Favored Glycine 0 N--CA 1.487 2.068 0 C-N-CA 120.84 -0.695 . . . . 0.23 112.002 -178.472 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.6 Cg_endo -60.33 -28.87 87.66 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 CA-C-N 119.742 1.771 . . . . 0.31 113.148 -179.685 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.89 -47.46 21.11 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.721 -1.237 . . . . 0.24 110.018 -179.735 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -59.98 -32.27 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.293 -0.879 . . . . 1.59 109.411 179.601 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 18.3 tmm? -60.11 -29.64 68.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.591 -0.693 . . . . 2.1 109.639 -179.934 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 38' ' ' ILE . 16.9 mt -81.59 -5.79 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.791 -0.568 . . . . 0.49 111.282 -179.107 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.559 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.62 -31.04 8.52 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 119.896 -1.753 . . . . 0.8 113.427 -177.927 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.1 Cg_exo -60.04 -40.54 60.32 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 CA-C-N 121.297 1.499 . . . . 0.28 112.821 -178.204 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -70.17 -47.91 59.56 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.746 -1.222 . . . . 0.37 108.673 179.798 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.58 -50.66 72.64 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.302 -0.874 . . . . 0.16 109.004 179.481 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -67.85 -40.24 83.7 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.699 -0.625 . . . . 0.32 111.276 179.187 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 75.3 m -63.58 -39.31 94.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.647 -1.283 . . . . 0.22 110.635 -179.342 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.3 mt -60.13 -27.15 66.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.396 -0.815 . . . . 0.22 110.909 -178.571 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.5 m -50.09 -37.5 34.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.975 -1.078 . . . . 0.16 108.986 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.2 mp0 -87.59 -16.75 33.66 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.205 -0.935 . . . . 2.16 108.942 179.698 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -77.73 -35.99 51.32 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.316 -1.365 . . . . 1.78 107.316 179.462 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -124.28 69.21 1.07 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.261 -1.385 . . . . 0.25 107.261 177.953 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.0 p -65.66 -8.97 23.39 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.729 -0.841 . . . . 0.22 108.729 -179.511 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -91.13 10.15 28.12 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.72 146.42 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.706 -1.22 . . . . 0.24 107.706 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.93 121.43 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.818 -1.176 . . . . 0.15 109.78 -178.949 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.534 ' C ' HD12 ' A' ' 55' ' ' LEU . 45.6 m-85 -102.78 124.2 47.87 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.255 -0.903 . . . . 0.12 109.999 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.2 mp -110.18 142.7 41.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.266 -0.896 . . . . 0.22 109.017 178.872 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -113.02 130.32 56.18 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 106.738 -1.578 . . . . 1.13 106.738 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.77 134.18 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.051 -1.031 . . . . 0.15 111.171 -177.777 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.701 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 53.5 t0 -98.97 119.44 37.75 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.499 -0.926 . . . . 1.05 108.499 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.6 m -69.09 -17.7 22.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 O-C-N 120.734 -1.229 . . . . 0.16 108.889 179.349 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.0 m-20 -92.64 -39.95 11.02 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.44 -0.788 . . . . 1.08 110.939 -179.079 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -98.5 -12.25 21.47 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.864 -1.148 . . . . 1.07 107.935 178.976 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -127.58 39.33 3.9 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.285 -1.376 . . . . 0.14 107.285 179.3 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -59.78 -27.74 66.81 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 115.868 -0.606 . . . . 1.47 109.385 -178.757 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.69 -38.14 88.41 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.187 -0.946 . . . . 1.05 109.329 179.353 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.527 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 8.9 t -69.72 -44.15 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.121 -0.987 . . . . 0.35 109.364 -179.917 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.36 -39.14 71.46 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.743 -0.598 . . . . 0.26 110.592 -179.036 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -61.17 -36.35 79.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.038 -1.039 . . . . 0.24 109.844 -179.01 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -61.98 -37.19 83.88 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.09 -1.006 . . . . 2.06 109.392 179.431 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.71 -0.88 57.73 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.342 -0.849 . . . . 0.23 111.364 -178.672 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 56.3 52.2 10.49 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.203 -0.936 . . . . 2.02 109.438 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.7 t -66.48 130.94 32.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 118.371 -1.332 . . . . 0.16 108.575 -179.169 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -104.06 -11.01 17.61 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.681 -0.637 . . . . 1.6 109.522 -179.422 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.416 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.54 154.28 16.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.878 -1.139 . . . . 0.14 110.938 179.906 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.8 p -129.63 156.08 79.31 Favored Pre-proline 0 N--CA 1.499 1.988 0 N-CA-C 106.828 -1.545 . . . . 0.15 106.828 178.447 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -76.16 140.94 68.69 Favored 'Cis proline' 0 N--CA 1.49 1.292 0 C-N-CA 123.818 -1.326 . . . . 0.16 111.788 -3.04 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.9 m -128.46 135.1 49.0 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.68 -0.859 . . . . 0.13 108.68 178.784 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.567 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.3 m-85 -108.83 128.83 55.24 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.873 -0.788 . . . . 0.2 108.873 -179.43 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -121.15 140.02 52.56 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.62 -1.252 . . . . 0.29 107.62 178.773 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.416 ' CE2' HG22 ' A' ' 24' ' ' VAL . 69.6 m-85 -107.72 135.08 49.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.257 0.551 . . . . 0.14 110.241 -178.942 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -126.88 147.23 50.07 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.165 -0.68 . . . . 0.15 109.165 178.985 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -146.16 125.08 12.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 106.986 -1.487 . . . . 1.68 106.986 179.378 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 57.97 27.1 14.26 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.099 -1.074 . . . . 1.22 108.099 -178.296 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.53 11.3 84.26 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.112 -1.195 . . . . 0.23 110.112 179.944 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -112.98 133.39 54.96 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.511 -0.994 . . . . 2.07 110.253 -179.26 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -81.47 120.02 24.47 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.583 -0.895 . . . . 1.82 108.583 178.858 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.6 m -121.76 13.01 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.857 -0.527 . . . . 0.3 110.517 -179.288 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.59 154.79 14.29 Favored Glycine 0 N--CA 1.496 2.687 0 C-N-CA 118.304 -1.903 . . . . 0.17 112.284 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -167.2 150.6 6.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.656 -0.908 . . . . 1.93 109.816 179.397 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -164.47 160.21 20.26 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 119.284 -0.966 . . . . 0.14 109.102 177.082 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.77 161.49 27.23 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.445 -0.784 . . . . 0.12 110.52 -179.055 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.433 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.51 138.91 5.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.574 -1.41 . . . . 0.12 109.574 179.16 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.05 67.17 1.7 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.269 -1.136 . . . . 0.18 109.765 -179.588 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -118.89 96.97 5.47 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.813 -0.81 . . . . 0.88 108.813 178.877 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -70.15 -33.43 71.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.173 -0.954 . . . . 1.06 111.72 -179.55 . . . . . . . . 3 3 . 1 . 033 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -62.97 -30.2 71.4 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.693 -1.255 . . . . 1.61 108.641 -179.85 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -60.61 -36.59 78.96 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.449 0.643 . . . . 1.45 109.498 -179.844 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 97' ' ' LEU . . . . . 0.472 HD21 ' CD1' ' A' ' 77' ' ' PHE . 39.7 mt -59.05 -37.94 78.21 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.982 0.896 . . . . 0.19 108.624 179.886 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -62.89 -42.39 99.76 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 120.128 -0.629 . . . . 2.1 110.851 -177.815 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.88 -43.47 68.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.051 -1.03 . . . . 0.19 111.655 -178.399 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -64.65 -39.95 94.58 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.701 -1.249 . . . . 0.2 110.506 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.17 -48.89 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.15 -1.055 . . . . 0.16 108.15 179.252 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.423 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.0 t-20 -60.69 -34.03 73.74 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.543 -0.91 . . . . 0.95 108.543 178.904 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -68.01 -39.29 83.21 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.669 -0.645 . . . . 2.21 110.282 -178.883 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.66 ' HB2' HD11 ' A' ' 22' ' ' LEU . 92.5 mt -100.37 -3.72 30.56 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.407 -0.808 . . . . 0.25 110.978 -178.706 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.4 p . . . . . 0 N--CA 1.495 1.803 0 O-C-N 120.552 -1.343 . . . . 1.08 108.658 -179.762 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt . . . . . 0 N--CA 1.492 1.664 0 N-CA-C 108.873 -0.788 . . . . 1.31 108.873 . . . . . . . . . 0 0 . 1 . 033 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.433 HD11 ' HA2' ' A' ' 91' ' ' GLY . 36.1 mm -127.97 140.69 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 N-CA-C 109.199 -0.667 . . . . 0.15 109.199 -179.954 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.5 m -97.56 122.39 40.58 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 107.165 -1.42 . . . . 0.19 107.165 177.558 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.2 m -77.79 140.3 39.42 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.85 -1.156 . . . . 0.2 111.851 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.416 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.3 m95 -74.7 -11.98 60.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -0.9 . . . . 0.21 109.685 179.236 . . . . . . . . 2 2 . 1 . 033 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.134 -0.979 . . . . 0.49 108.546 179.826 . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.2 tptt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 108.372 -0.973 . . . . 1.67 108.372 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -96.63 122.79 39.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.239 -0.913 . . . . 0.31 108.856 -179.876 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.7 mm -100.62 111.55 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.19 108.678 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.448 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.2 mp0 -96.55 0.5 50.18 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.15 -0.969 . . . . 2.25 109.884 -179.421 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.1 p -154.13 156.12 36.63 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.026 -1.046 . . . . 0.15 111.04 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -64.74 -33.29 75.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.438 -0.949 . . . . 1.65 108.438 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 51.6 m -57.38 -46.31 83.55 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.48 -0.933 . . . . 0.23 108.48 -179.136 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 -31.85 70.37 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.903 -0.777 . . . . 0.17 108.903 178.689 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CE2' HD11 ' A' ' 15' ' ' LEU . 51.4 t80 -58.52 -43.73 89.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.304 -0.873 . . . . 0.14 109.046 -179.527 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -66.21 -42.76 88.29 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.529 -0.868 . . . . 1.31 108.891 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -63.63 -39.51 94.53 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.644 -0.66 . . . . 1.77 110.82 179.752 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.96 82.59 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.154 -0.966 . . . . 0.15 109.24 -179.659 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.508 HD11 ' CE2' ' A' ' 11' ' ' PHE . 79.7 mt -61.09 -40.15 92.63 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.087 -1.079 . . . . 0.17 108.087 179.218 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.04 -37.13 78.41 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.769 -0.582 . . . . 1.07 110.513 179.72 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.09 -36.03 79.13 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.146 -0.971 . . . . 0.18 110.27 -178.924 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.7 72.55 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.078 -1.014 . . . . 0.17 109.09 179.827 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.66 -124.02 23.45 Favored Glycine 0 N--CA 1.484 1.9 0 N-CA-C 109.417 -1.473 . . . . 0.2 109.417 -179.853 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -92.14 3.89 54.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.242 -1.152 . . . . 1.07 110.983 -179.301 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -75.8 148.71 38.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.751 -1.218 . . . . 1.5 109.118 -179.914 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.683 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.7 158.56 12.45 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 107.137 -1.431 . . . . 0.47 107.137 179.759 . . . . . . . . 3 3 . 1 . 034 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.639 ' H ' HD23 ' A' ' 22' ' ' LEU . 44.1 t -146.24 119.2 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 120.651 -1.281 . . . . 0.17 108.732 179.654 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.439 HG22 ' CE2' ' A' ' 79' ' ' PHE . 21.5 t -106.52 140.99 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.664 -1.236 . . . . 0.14 107.664 179.045 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.6 t -123.54 121.95 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.439 -0.788 . . . . 0.13 109.483 -179.075 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -100.14 120.26 39.6 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.493 -0.754 . . . . 1.05 109.919 179.883 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 23.31 7.16 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.257 -0.902 . . . . 0.73 110.137 179.507 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 28' ' ' SER . . . . . 0.464 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.0 m -57.43 146.26 30.08 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.032 -1.043 . . . . 0.3 110.639 -178.731 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.602 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.47 124.76 31.71 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 107.709 -1.219 . . . . 0.22 107.709 178.991 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -67.9 -33.59 75.0 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 118.657 -1.217 . . . . 0.3 108.453 -179.627 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.602 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 52.5 p-90 -70.04 -24.16 63.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.289 -0.882 . . . . 0.26 110.944 179.488 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.2 t -83.44 119.75 25.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.86 -1.15 . . . . 0.26 107.994 -179.456 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.449 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.58 -52.15 52.94 Favored Glycine 0 N--CA 1.49 2.241 0 C-N-CA 120.397 -0.906 . . . . 0.23 110.883 -178.383 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.9 Cg_exo -52.06 -37.39 68.35 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 CA-C-N 118.571 1.185 . . . . 0.31 112.635 179.59 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 35' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.38 -51.45 10.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.304 -0.873 . . . . 0.24 109.831 -179.808 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -60.07 -35.44 75.16 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.216 -0.928 . . . . 1.59 109.706 179.678 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.499 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.39 -27.74 66.27 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.502 -0.749 . . . . 2.1 109.789 -179.726 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 38' ' ' ILE . 59.9 mt -87.86 -0.84 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.644 -0.66 . . . . 0.49 111.157 -178.786 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.583 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 1.5 ptmt -64.84 -31.36 5.4 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.299 -1.501 . . . . 0.8 112.904 -178.69 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.6 Cg_exo -56.42 -39.4 91.55 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 CA-C-N 121.026 1.402 . . . . 0.28 113.277 -177.767 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -67.99 -47.23 69.12 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.279 -1.369 . . . . 0.37 108.292 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -60.14 -53.0 62.95 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.778 0.799 . . . . 0.16 110.155 178.805 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -68.63 -40.3 80.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.72 -0.613 . . . . 0.32 111.188 -179.42 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.422 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 67.1 m -62.62 -40.02 95.67 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.958 -1.089 . . . . 0.22 110.769 -179.45 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -63.12 -20.87 65.77 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.307 -0.871 . . . . 0.22 110.371 -178.493 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -52.08 -39.82 60.27 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 120.759 -1.213 . . . . 0.16 108.718 -178.982 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -82.74 -17.83 42.9 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.231 -0.918 . . . . 2.16 109.596 179.246 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -76.81 -35.99 57.23 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.675 -1.266 . . . . 1.78 107.816 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -123.37 67.98 1.0 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 106.564 -1.643 . . . . 0.25 106.564 177.445 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -10.44 15.33 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.934 -0.765 . . . . 0.22 108.934 -179.265 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -89.83 8.25 32.95 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.869 -0.789 . . . . 1.13 108.869 179.481 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.7 t -126.64 147.26 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 107.539 -1.282 . . . . 0.24 107.539 178.617 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -100.27 123.45 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.015 -1.053 . . . . 0.15 109.342 -178.658 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.539 ' C ' HD12 ' A' ' 55' ' ' LEU . 59.3 m-85 -106.09 123.96 48.83 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.136 -0.977 . . . . 0.12 109.689 179.569 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.539 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -110.0 140.16 44.31 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.077 -1.014 . . . . 0.22 109.652 178.936 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -109.93 131.45 55.05 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 106.942 -1.503 . . . . 1.13 106.942 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.79 135.25 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.428 -0.795 . . . . 0.15 110.576 -177.992 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 58' ' ' ASP . . . . . 0.639 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 53.8 t0 -97.49 119.71 36.53 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.19 -1.041 . . . . 1.05 108.19 179.186 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -68.38 -18.47 23.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.635 -1.291 . . . . 0.16 108.672 179.693 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.3 -40.76 10.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.384 -0.823 . . . . 1.08 111.505 -178.764 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.28 -13.69 23.18 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.717 -1.24 . . . . 1.07 108.106 179.516 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 62' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -125.59 37.83 4.29 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.426 -1.324 . . . . 0.14 107.426 179.164 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -59.7 -23.67 63.32 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.812 -0.81 . . . . 1.47 108.812 -178.757 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.2 p30 -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.979 -1.076 . . . . 1.05 108.757 178.811 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.469 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 4.5 t -71.18 -46.88 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 CA-C-O 121.619 0.723 . . . . 0.35 109.88 179.873 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.48 -37.14 68.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.668 -0.645 . . . . 0.26 110.597 -178.643 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -60.09 -37.43 79.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.154 -0.967 . . . . 0.24 109.466 -179.293 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.28 -33.92 76.83 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.401 -0.812 . . . . 2.06 109.099 179.163 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.92 0.45 53.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.504 -0.747 . . . . 0.23 110.402 -179.34 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.7 mp0 53.14 50.05 18.63 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 2.02 110.379 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.4 t -67.99 134.41 30.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 O-C-N 120.59 -1.319 . . . . 0.16 108.74 -179.897 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -105.21 -12.94 15.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.548 -0.72 . . . . 1.6 109.844 -179.609 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.511 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.96 158.22 19.42 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.925 -1.11 . . . . 0.14 110.584 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 36.9 p -129.94 155.29 80.82 Favored Pre-proline 0 N--CA 1.502 2.169 0 N-CA-C 108.494 -0.928 . . . . 0.15 108.494 179.248 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -75.14 140.15 65.57 Favored 'Cis proline' 0 N--CA 1.497 1.734 0 C-N-CA 123.871 -1.304 . . . . 0.16 113.157 -2.112 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 90.0 m -125.39 130.34 51.69 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.263 -1.014 . . . . 0.13 108.263 178.163 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 77' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 91.9 m-85 -109.16 131.16 55.33 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 108.669 -0.863 . . . . 0.2 108.669 -179.529 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -123.0 141.91 51.43 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.347 -0.845 . . . . 0.29 108.743 179.764 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 79' ' ' PHE . . . . . 0.439 ' CE2' HG22 ' A' ' 24' ' ' VAL . 71.8 m-85 -108.1 135.12 49.99 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.558 0.694 . . . . 0.14 110.741 -179.001 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -129.87 143.57 50.87 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.125 -0.695 . . . . 0.15 109.125 179.253 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -147.19 130.98 17.0 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 107.167 -1.42 . . . . 1.68 107.167 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 70.5 mttt 58.83 26.1 14.39 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.697 -0.853 . . . . 1.22 108.697 -178.403 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.15 22.13 71.83 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.949 -1.26 . . . . 0.23 109.949 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -129.71 141.52 50.88 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.356 -1.085 . . . . 2.07 110.406 -179.845 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -79.39 125.47 29.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.271 -0.893 . . . . 1.82 109.466 179.664 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 m -123.66 11.24 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.763 -0.586 . . . . 0.3 110.296 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.51 157.98 20.87 Favored Glycine 0 N--CA 1.497 2.701 0 C-N-CA 118.602 -1.761 . . . . 0.17 111.523 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 88' ' ' GLU . . . . . 0.472 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.1 tp10 -167.23 148.64 5.75 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.775 -0.838 . . . . 1.93 109.146 179.578 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.472 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.5 p90 -169.28 156.93 7.23 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.504 -0.748 . . . . 0.14 109.936 178.108 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.3 p -126.48 163.63 22.92 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.484 -0.76 . . . . 0.12 109.646 -179.588 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.481 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.85 142.48 6.69 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.324 -1.511 . . . . 0.12 109.324 179.836 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 92' ' ' ALA . . . . . 0.459 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.68 65.67 3.22 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.316 -1.108 . . . . 0.18 110.1 -179.542 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -119.04 96.03 5.06 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.367 -0.975 . . . . 0.88 108.367 178.653 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -32.34 72.25 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 1.06 111.373 -179.287 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.36 -30.05 70.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.829 -1.17 . . . . 1.61 109.765 -179.566 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.42 -34.19 73.59 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.07 -0.715 . . . . 1.45 109.07 -179.035 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.91 -39.38 85.2 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.158 0.98 . . . . 0.19 108.571 179.226 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -60.68 -44.02 97.0 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 120.174 -0.61 . . . . 2.1 110.826 -178.324 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.62 -44.02 71.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.19 111.603 -178.203 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.0 m -64.0 -39.92 95.19 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 120.853 -1.154 . . . . 0.2 109.683 -178.864 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.84 -49.48 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 N-CA-C 108.077 -1.083 . . . . 0.16 108.077 178.876 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.519 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.2 t-20 -60.18 -35.23 74.9 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.257 -1.016 . . . . 0.95 108.257 179.166 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -68.0 -40.07 83.09 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.436 -0.79 . . . . 2.21 110.616 -179.188 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.683 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.4 mt -98.78 -3.44 35.61 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.232 -0.917 . . . . 0.25 111.185 -178.533 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.519 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.5 p . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.589 -1.319 . . . . 1.08 109.105 -179.758 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 109.692 -0.484 . . . . 1.31 109.692 . . . . . . . . . 0 0 . 1 . 034 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.481 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.8 mm -130.02 142.01 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.677 -0.639 . . . . 0.15 109.856 -179.208 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.5 m -101.27 129.28 47.21 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.538 -1.282 . . . . 0.19 107.538 177.961 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 58.5 m -78.72 140.61 38.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.851 -1.156 . . . . 0.2 110.644 -178.897 . . . . . . . . 1 1 . 1 . 034 nuclear build core ' B' B ' 67' ' ' TRP . . . . . 0.411 ' NE1' HG23 ' A' ' 74' ' ' THR . 18.5 m95 -76.15 -10.11 59.16 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.801 -1.187 . . . . 0.21 109.566 178.972 . . . . . . . . 2 2 . 1 . 034 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 47.0 m-20 . . . . . 0 C--N 1.303 -1.453 0 O-C-N 121.184 -0.947 . . . . 0.49 108.558 -179.683 . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 tptp . . . . . 0 N--CA 1.496 1.86 0 N-CA-C 108.524 -0.917 . . . . 1.67 108.524 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -97.66 124.33 41.92 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.177 -0.952 . . . . 0.31 108.699 179.679 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -103.27 113.81 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 N-CA-C 108.787 -0.82 . . . . 0.19 108.787 179.426 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.417 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.3 mp0 -96.09 -1.05 49.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.993 . . . . 2.25 110.092 -179.463 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -155.49 156.66 35.63 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.885 -1.135 . . . . 0.15 111.376 -179.816 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 8' ' ' LYS . . . . . 0.725 ' HZ1' ' HB2' ' A' ' 68' ' ' GLU . 14.5 ttmm -64.08 -31.96 73.35 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.456 -0.942 . . . . 1.65 108.456 178.658 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.0 m -56.72 -49.07 76.27 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.276 -0.97 . . . . 0.23 108.559 -179.478 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -30.72 69.01 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.48 -0.763 . . . . 0.17 109.21 178.782 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 11' ' ' PHE . . . . . 0.491 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.5 t80 -59.67 -42.53 93.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.14 108.875 -179.354 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -65.77 -42.5 90.77 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.31 -0.996 . . . . 1.31 108.31 179.533 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -64.27 -37.33 87.09 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.285 0.564 . . . . 1.77 110.173 179.497 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.95 77.75 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.266 -0.896 . . . . 0.15 108.986 -179.477 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 15' ' ' LEU . . . . . 0.491 HD11 ' CE2' ' A' ' 11' ' ' PHE . 54.6 mt -60.72 -40.79 93.66 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.516 -0.873 . . . . 0.17 108.668 179.908 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -68.66 -38.1 80.15 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 1.07 110.238 179.573 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.81 -37.31 84.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.347 -0.845 . . . . 0.18 110.201 -178.694 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.83 73.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.026 -1.046 . . . . 0.17 109.385 179.893 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -124.48 22.48 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.897 -1.281 . . . . 0.2 109.897 -179.6 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.24 4.48 52.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.398 -1.06 . . . . 1.07 110.149 -179.206 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -75.79 147.74 38.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.973 -1.079 . . . . 1.5 108.848 -179.673 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.716 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.51 159.56 6.3 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 107.387 -1.338 . . . . 0.47 107.387 -179.392 . . . . . . . . 3 3 . 1 . 035 nuclear build core ' A' A ' 23' ' ' VAL . . . . . 0.716 ' H ' HD23 ' A' ' 22' ' ' LEU . 67.1 t -148.48 118.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 120.964 -1.085 . . . . 0.17 108.097 179.578 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 t -106.48 142.73 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.912 -1.144 . . . . 0.14 107.912 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.0 t -125.92 122.46 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.414 -0.804 . . . . 0.13 109.82 -178.76 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -99.09 118.85 36.77 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.303 -0.873 . . . . 1.05 109.456 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -94.79 20.49 8.66 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.155 -0.966 . . . . 0.73 109.285 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -55.94 147.87 18.56 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 120.974 -1.079 . . . . 0.3 110.276 -178.623 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 29' ' ' ALA . . . . . 0.713 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.51 126.03 32.93 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.398 -1.334 . . . . 0.22 107.398 178.61 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -69.07 -32.02 71.17 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.661 -1.215 . . . . 0.3 107.829 179.395 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 31' ' ' TRP . . . . . 0.713 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 62.8 p-90 -70.42 -22.42 62.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.69 -0.631 . . . . 0.26 110.98 179.81 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.2 t -84.74 115.33 22.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.788 -1.195 . . . . 0.26 108.239 -179.772 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 33' ' ' GLY . . . . . 0.445 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.29 -51.89 55.16 Favored Glycine 0 N--CA 1.488 2.15 0 C-N-CA 120.437 -0.887 . . . . 0.23 111.391 -178.397 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.2 Cg_exo -51.81 -35.45 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 CA-C-N 118.809 1.305 . . . . 0.31 111.325 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.98 -50.29 13.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.531 -0.731 . . . . 0.24 110.09 -179.747 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -59.81 -34.95 73.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.086 -1.009 . . . . 1.59 109.026 -179.765 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 37' ' ' MET . . . . . 0.54 ' SD ' ' O ' ' A' ' 37' ' ' MET . 10.1 tmm? -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.403 -0.81 . . . . 2.1 109.313 179.917 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 38' ' ' ILE . . . . . 0.571 HG22 ' O ' ' A' ' 38' ' ' ILE . 74.9 mt -84.95 -1.99 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.588 -0.695 . . . . 0.49 111.603 -178.938 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 39' ' ' LYS . . . . . 0.574 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 18.2 pttt -65.44 -30.11 3.82 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 120.168 -1.582 . . . . 0.8 113.26 -178.627 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 40' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.2 Cg_exo -55.08 -40.06 87.76 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 121.403 1.537 . . . . 0.28 112.533 -177.067 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.26 -45.04 74.24 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 118.367 -1.333 . . . . 0.37 108.35 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.13 -51.63 67.08 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.21 -0.931 . . . . 0.16 109.697 179.36 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.5 t-80 -67.33 -41.84 84.59 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.524 0.678 . . . . 0.32 110.741 179.841 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 44' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.3 m -62.22 -39.94 94.44 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.273 -0.892 . . . . 0.22 110.195 -179.287 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.74 -23.14 64.72 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.344 -0.848 . . . . 0.22 110.613 -179.023 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.2 m -53.36 -35.38 60.2 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.801 -1.187 . . . . 0.16 108.849 -179.254 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 47' ' ' GLU . . . . . 0.534 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.3 mp0 -88.88 -13.38 39.31 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.195 -0.941 . . . . 2.16 108.959 179.198 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -77.77 -39.97 42.37 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.814 -1.18 . . . . 1.78 107.814 178.698 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -123.87 69.6 1.06 Allowed 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.741 -1.577 . . . . 0.25 106.741 178.058 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.35 -9.07 10.41 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.543 -0.91 . . . . 0.22 108.543 -179.32 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -89.68 8.03 33.66 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.202 -1.036 . . . . 1.13 108.202 179.146 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 52' ' ' VAL . . . . . 0.47 HG13 ' HB3' ' A' ' 22' ' ' LEU . 56.0 t -126.45 142.74 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 N-CA-C 107.996 -1.113 . . . . 0.24 107.996 179.114 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 53' ' ' ILE . . . . . 0.427 HG22 ' CD1' ' A' ' 55' ' ' LEU . 30.7 mm -97.88 121.31 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.217 -0.927 . . . . 0.15 109.65 -178.995 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 54' ' ' PHE . . . . . 0.524 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.6 m-85 -101.63 125.4 48.28 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.391 -0.818 . . . . 0.12 109.385 179.551 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.524 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -110.28 144.85 38.37 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.075 -1.016 . . . . 0.22 110.097 179.14 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -112.52 131.51 55.56 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.216 -1.402 . . . . 1.13 107.216 177.825 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -128.21 132.08 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.404 -0.81 . . . . 0.15 109.744 -178.849 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -95.11 120.0 34.57 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.872 -0.788 . . . . 1.05 108.872 179.873 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -64.99 -19.84 26.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.813 0 O-C-N 120.378 -1.451 . . . . 0.16 107.876 179.199 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 60' ' ' ASP . . . . . 0.499 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 28.5 m-20 -92.64 -41.67 10.06 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.457 -0.777 . . . . 1.08 112.403 -178.746 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -95.67 -18.23 20.67 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.36 -1.463 . . . . 1.07 108.99 -179.576 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.82 40.7 3.66 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.735 -1.209 . . . . 0.14 107.735 179.029 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -60.18 -19.13 52.63 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.469 -0.567 . . . . 1.47 109.469 -179.161 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 64' ' ' ASP . . . . . 0.59 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -62.22 -39.43 92.76 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.985 -1.072 . . . . 1.05 108.849 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 65' ' ' VAL . . . . . 0.59 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.2 t -73.69 -43.98 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 O-C-N 121.274 -0.891 . . . . 0.35 109.849 -179.973 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.37 -40.57 81.39 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.396 -0.815 . . . . 0.26 110.471 -178.273 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.6 p -60.32 -39.29 86.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.048 -1.032 . . . . 0.24 109.177 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 68' ' ' GLU . . . . . 0.725 ' HB2' ' HZ1' ' A' ' 8' ' ' LYS . 40.4 tt0 -62.97 -38.99 93.34 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.337 -0.852 . . . . 2.06 109.832 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.68 -2.5 58.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.437 -0.789 . . . . 0.23 111.179 -178.416 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 56.03 49.15 16.26 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.163 -0.96 . . . . 2.02 109.947 -179.913 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.84 132.47 28.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 118.586 -1.246 . . . . 0.16 108.038 -179.617 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -105.26 -12.17 16.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.478 -0.764 . . . . 1.6 110.173 -179.039 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 73' ' ' ALA . . . . . 0.465 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.86 156.22 17.44 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.829 -1.169 . . . . 0.14 111.071 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -127.72 156.28 75.89 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 107.966 -1.124 . . . . 0.15 107.966 179.087 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -74.36 143.39 77.68 Favored 'Cis proline' 0 N--CA 1.494 1.547 0 C-N-CA 123.85 -1.312 . . . . 0.16 112.851 -3.682 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 76' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -128.24 133.7 48.87 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.492 -0.929 . . . . 0.13 108.492 177.926 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -111.46 131.69 55.03 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 108.803 -0.814 . . . . 0.2 108.803 -179.236 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -122.96 140.61 52.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.29 109.161 179.457 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -108.28 135.55 49.42 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.309 0.576 . . . . 0.14 110.448 -179.207 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -126.32 149.16 49.35 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.43 0.633 . . . . 0.15 109.434 179.341 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -146.76 126.41 13.37 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 106.964 -1.495 . . . . 1.68 106.964 -179.734 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.9 mttp 54.02 34.08 18.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.938 -1.101 . . . . 1.22 108.677 -177.987 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.64 20.71 79.72 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 110.017 -1.233 . . . . 0.23 110.017 179.568 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -124.45 133.5 53.35 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.427 -1.043 . . . . 2.07 110.611 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -78.4 124.06 27.69 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.241 -0.912 . . . . 1.82 109.732 179.657 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.4 m -123.99 10.8 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.663 -0.648 . . . . 0.3 110.522 -179.578 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.83 151.26 10.6 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 118.564 -1.779 . . . . 0.17 111.451 -179.819 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -164.92 148.01 8.48 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.815 -0.815 . . . . 1.93 109.045 179.285 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 89' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 11.1 p90 -164.19 159.03 19.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.198 -0.939 . . . . 0.14 110.025 178.16 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.24 159.98 31.56 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.58 0.705 . . . . 0.12 109.786 -179.529 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 91' ' ' GLY . . . . . 0.474 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.37 143.0 6.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.241 -1.544 . . . . 0.12 109.241 179.099 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.39 66.58 2.47 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.258 -1.142 . . . . 0.18 109.606 -179.879 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -119.84 92.51 3.8 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 108.175 -1.046 . . . . 0.88 108.175 178.909 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.97 -32.53 73.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.445 -0.784 . . . . 1.06 111.196 -179.093 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -63.92 -30.8 71.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.035 -1.041 . . . . 1.61 109.521 -179.619 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.36 -35.33 75.44 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 109.215 -0.661 . . . . 1.45 109.215 -179.003 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.86 -38.88 83.38 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.562 -0.903 . . . . 0.19 108.562 179.106 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.47 -43.75 98.31 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 120.261 -0.576 . . . . 2.1 110.673 -178.029 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.88 -43.81 71.07 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.211 -0.931 . . . . 0.19 111.543 -178.768 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -64.17 -39.93 95.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.868 -1.145 . . . . 0.2 110.18 -178.585 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.3 mt -61.39 -48.97 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 108.162 -1.051 . . . . 0.16 108.162 179.118 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 102' ' ' ASN . . . . . 0.51 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.1 t-20 -60.63 -34.62 74.55 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.389 -0.967 . . . . 0.95 108.389 179.448 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -68.03 -39.93 83.02 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.532 -0.73 . . . . 2.21 110.909 -178.587 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' A' A ' 104' ' ' LEU . . . . . 0.505 ' HB2' HD11 ' A' ' 22' ' ' LEU . 88.0 mt -100.17 0.22 40.09 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.108 -0.995 . . . . 0.25 111.141 -178.333 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' A' A ' 105' ' ' VAL . . . . . 0.51 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.683 -1.26 . . . . 1.08 109.464 -179.489 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 109.132 -0.692 . . . . 1.31 109.132 . . . . . . . . . 0 0 . 1 . 035 nuclear build core ' B' B ' 64' ' ' ILE . . . . . 0.474 HD11 ' HA2' ' A' ' 91' ' ' GLY . 28.9 mm -135.85 142.43 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 N-CA-C 109.406 -0.59 . . . . 0.15 109.406 -179.649 . . . . . . . . 2 2 . 1 . 035 nuclear build core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 9.4 m -101.71 127.2 48.58 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 107.543 -1.28 . . . . 0.19 107.543 177.634 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.1 m -78.81 139.94 38.29 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.865 -1.147 . . . . 0.2 111.562 -178.291 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -72.94 -8.75 57.08 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.912 -0.773 . . . . 0.21 108.912 178.283 . . . . . . . . 1 1 . 1 . 035 nuclear build core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 . . . . . 0 C--N 1.301 -1.516 0 N-CA-C 108.794 -0.817 . . . . 0.49 108.794 179.37 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mmm . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.219 0.533 . . . . 2.88 109.685 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.0 t -98.92 138.86 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.273 0 O-C-N 121.434 -0.791 . . . . 0.45 109.739 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -130.59 127.55 39.25 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 1.67 109.296 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -94.64 123.22 37.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.31 108.748 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.9 mm -99.87 116.47 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.896 -1.15 . . . . 0.19 107.896 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.516 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 55.1 mp0 -99.48 -1.08 39.36 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.34 -0.85 . . . . 2.25 109.274 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -155.74 156.49 34.94 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.988 -1.07 . . . . 0.15 111.481 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -63.34 -31.45 72.61 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.332 -0.988 . . . . 1.65 108.332 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 87.1 m -59.51 -47.52 85.22 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.729 -0.841 . . . . 0.23 108.729 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -30.5 69.8 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.381 -0.825 . . . . 0.17 108.909 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.477 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.5 t80 -59.81 -41.42 91.21 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.378 -0.826 . . . . 0.14 109.276 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -66.78 -41.88 86.97 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.769 -0.826 . . . . 1.31 108.769 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.27 -40.45 93.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.825 -0.547 . . . . 1.77 110.686 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.27 87.38 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.244 -0.91 . . . . 0.15 109.278 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.477 HD11 ' CE2' ' A' ' 11' ' ' PHE . 70.8 mt -61.71 -39.95 93.33 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.868 -1.145 . . . . 0.17 108.574 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.99 -35.32 74.32 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.641 -0.662 . . . . 1.07 109.945 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.1 -36.48 79.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.24 -0.912 . . . . 0.18 109.901 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.4 -33.06 74.72 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 0.17 109.455 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.92 -127.28 24.82 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 109.583 -1.407 . . . . 0.2 109.583 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.446 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 69.2 m-20 -90.02 2.17 55.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.258 . . . . 1.07 110.456 -178.805 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -75.22 150.09 38.72 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.906 -1.121 . . . . 1.5 110.171 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.658 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.6 155.21 15.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 107.395 -1.335 . . . . 0.47 107.395 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.656 ' H ' HD23 ' A' ' 22' ' ' LEU . 89.5 t -142.38 110.43 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.187 -0.946 . . . . 0.17 108.954 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.1 t -97.37 142.58 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 N-CA-C 108.28 -1.007 . . . . 0.14 108.28 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.1 t -124.48 124.61 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.191 -0.943 . . . . 0.13 109.49 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.531 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -101.97 118.17 36.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.488 -0.757 . . . . 1.05 109.963 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 67.0 m-85 -95.8 21.63 8.28 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.288 -0.882 . . . . 0.73 109.531 179.046 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -57.5 148.59 23.3 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.926 -1.109 . . . . 0.3 110.697 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.668 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.04 123.93 32.66 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.054 -1.091 . . . . 0.22 108.054 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.6 t -67.94 -31.38 71.1 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.783 -1.167 . . . . 0.3 108.303 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.668 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.9 p-90 -71.05 -24.27 62.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.578 -0.701 . . . . 0.26 110.645 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -85.18 119.31 25.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.942 -1.098 . . . . 0.26 108.101 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.438 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.31 -53.22 47.37 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 111.134 -0.786 . . . . 0.23 111.134 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.6 Cg_exo -53.05 -37.16 78.68 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 CA-C-N 118.515 1.158 . . . . 0.31 112.344 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.6 6.63 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.487 -0.758 . . . . 0.24 110.083 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.84 -36.74 77.46 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.01 -1.056 . . . . 1.59 109.813 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.513 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.11 -29.73 67.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -0.798 . . . . 2.1 110.244 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.62 HG22 ' O ' ' A' ' 38' ' ' ILE . 52.3 mt -83.89 0.45 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.439 -0.788 . . . . 0.49 110.999 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.566 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 12.9 ptmt -68.03 -28.52 1.89 Allowed Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 120.57 -1.331 . . . . 0.8 113.406 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.566 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.3 Cg_exo -53.03 -39.61 79.06 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 CA-C-N 121.857 1.699 . . . . 0.28 112.92 -176.8 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -69.13 -45.17 70.78 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 118.438 -1.305 . . . . 0.37 108.735 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -60.21 -52.97 63.05 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.132 -0.98 . . . . 0.16 109.694 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -68.71 -44.25 74.28 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.623 -0.673 . . . . 0.32 110.726 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 54.4 m -60.64 -39.7 89.26 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.059 -1.026 . . . . 0.22 111.186 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -64.53 -19.65 65.73 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.963 -1.086 . . . . 0.22 110.945 -177.716 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -49.87 -39.84 40.68 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.902 -1.124 . . . . 0.16 108.66 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -84.53 -13.82 50.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.69 -1.257 . . . . 2.16 109.485 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -76.44 -36.29 58.04 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.613 -1.254 . . . . 1.78 107.613 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -125.85 68.88 1.18 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.023 -1.473 . . . . 0.25 107.023 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -64.28 -7.95 11.16 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.509 -0.745 . . . . 0.22 109.113 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -91.48 8.99 33.74 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.898 -1.149 . . . . 1.13 107.898 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 38.8 t -128.0 141.82 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 107.875 -1.157 . . . . 0.24 107.875 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -99.62 121.55 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.189 -0.945 . . . . 0.15 109.708 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.513 ' C ' HD12 ' A' ' 55' ' ' LEU . 40.7 m-85 -101.19 127.51 47.72 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.272 -0.893 . . . . 0.12 109.869 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -109.89 141.03 43.18 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.306 -0.871 . . . . 0.22 108.812 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -109.51 131.24 55.25 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 106.677 -1.601 . . . . 1.13 106.677 177.731 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -128.67 131.99 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.438 -0.789 . . . . 0.15 110.638 -177.976 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.615 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 40.2 t0 -96.01 120.12 35.73 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.828 -0.804 . . . . 1.05 108.828 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.5 m -67.89 -19.03 24.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 O-C-N 120.456 -1.402 . . . . 0.16 108.513 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.492 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 12.0 m-20 -92.58 -44.22 8.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.377 -0.827 . . . . 1.08 111.529 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.429 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 69.4 m-20 -94.23 -15.16 24.81 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.757 -1.214 . . . . 1.07 108.259 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.88 4.09 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.023 -1.102 . . . . 0.14 108.023 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -60.09 -26.54 66.28 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.59 -0.694 . . . . 1.47 110.35 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.513 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -64.1 -37.91 89.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.785 -1.197 . . . . 1.05 108.952 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.513 HG23 ' OD1' ' A' ' 64' ' ' ASP . 4.4 t -70.31 -44.24 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 121.275 -0.891 . . . . 0.35 109.249 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.8 -40.31 76.03 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.763 -0.586 . . . . 0.26 110.341 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.7 p -61.14 -33.59 73.64 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.199 -0.938 . . . . 0.24 109.222 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -60.36 -39.58 87.69 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.254 -0.904 . . . . 2.06 108.791 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.82 -1.49 58.0 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.349 -0.844 . . . . 0.23 110.913 -179.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 55.68 49.92 15.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.183 -0.948 . . . . 2.02 109.605 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.7 t -61.52 128.9 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 120.663 -1.273 . . . . 0.16 109.021 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -101.34 -10.91 19.85 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.712 -0.618 . . . . 1.6 110.045 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.474 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.61 155.99 17.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.689 -1.257 . . . . 0.14 110.459 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 33.9 p -129.22 154.05 80.51 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.075 -1.083 . . . . 0.15 108.075 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -75.53 141.65 71.79 Favored 'Cis proline' 0 N--CA 1.495 1.595 0 C-N-CA 123.862 -1.307 . . . . 0.16 113.148 -1.932 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.75 131.61 47.87 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.544 -0.91 . . . . 0.13 108.544 178.118 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.531 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.6 m-85 -108.82 130.65 55.4 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 109.001 -0.74 . . . . 0.2 109.001 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.428 HE21 ' HE3' ' A' ' 85' ' ' LYS . 28.5 mt-30 -122.81 140.48 52.88 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.247 -0.908 . . . . 0.29 108.601 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.404 ' CE1' HG21 ' A' ' 100' ' ' THR . 74.2 m-85 -107.78 136.03 48.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.762 -0.586 . . . . 0.14 110.228 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -127.1 149.22 50.04 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.023 -0.732 . . . . 0.15 109.023 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -145.77 120.48 9.85 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.772 -1.196 . . . . 1.68 107.772 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.446 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 52.8 mttm 59.38 30.73 20.48 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.629 -1.248 . . . . 1.22 107.629 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.21 15.79 81.17 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.654 -1.378 . . . . 0.23 109.654 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.7 mm100 -114.53 131.64 56.59 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.461 -1.023 . . . . 2.07 110.574 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.428 ' HE3' HE21 ' A' ' 78' ' ' GLN . 85.8 tttt -77.93 120.13 22.36 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.211 -0.93 . . . . 1.82 108.913 178.647 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.9 m -122.85 12.45 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.512 -0.742 . . . . 0.3 111.025 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.82 151.17 9.36 Favored Glycine 0 N--CA 1.49 2.297 0 C-N-CA 118.445 -1.836 . . . . 0.17 110.992 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.5 tm-20 -164.34 149.57 10.24 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.833 -0.804 . . . . 1.93 109.207 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 13.1 p90 -164.04 160.14 21.4 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.063 -1.055 . . . . 0.14 109.338 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.24 161.72 27.08 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.49 0.662 . . . . 0.12 109.749 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.456 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.98 141.04 5.82 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.542 -1.423 . . . . 0.12 109.542 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.496 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.06 66.4 2.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.18 109.903 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.9 t-20 -120.11 94.21 4.31 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.51 -0.744 . . . . 0.88 109.51 178.609 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -31.64 72.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.062 -1.024 . . . . 1.06 111.539 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.99 -30.37 70.91 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.612 -1.305 . . . . 1.61 109.806 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -59.92 -34.33 73.06 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.627 0.727 . . . . 1.45 109.837 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.59 -39.09 83.01 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 122.046 0.927 . . . . 0.19 108.693 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.42 -44.19 97.04 Favored 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 120.111 -0.636 . . . . 2.1 110.4 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.57 -43.29 69.74 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.22 -0.925 . . . . 0.19 111.365 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.404 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.6 m -64.56 -40.37 95.45 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.978 -1.076 . . . . 0.2 108.939 -178.717 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.6 mt -61.29 -46.08 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 106.843 -1.54 . . . . 0.16 106.843 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.5 ' O ' HG12 ' A' ' 105' ' ' VAL . 16.9 t-20 -60.48 -35.82 76.82 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.748 -0.834 . . . . 0.95 108.748 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -68.57 -39.95 80.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.547 -0.721 . . . . 2.21 110.111 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.658 ' HB2' HD11 ' A' ' 22' ' ' LEU . 80.2 mt -98.96 -0.09 42.88 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.107 -0.995 . . . . 0.25 111.624 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.619 -1.3 . . . . 1.08 109.682 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 N--CA 1.492 1.385 0 CA-C-O 121.186 0.411 . . . . 1.46 111.987 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -101.39 119.19 38.39 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.303 -0.873 . . . . 0.88 108.664 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.45 HG22 ' H ' ' B' ' 63' ' ' LYS . 22.1 m -108.19 128.6 54.85 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.333 -0.854 . . . . 0.7 108.988 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 79.5 mt -63.01 -29.46 70.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.119 -0.988 . . . . 0.61 109.404 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.45 ' H ' HG22 ' B' ' 61' ' ' THR . 47.9 mmtm -67.81 -16.95 64.35 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.568 -0.708 . . . . 1.31 109.509 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.456 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.9 mm -128.99 141.19 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.737 -0.602 . . . . 0.15 109.844 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.4 m -100.48 128.47 46.53 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.616 -1.624 . . . . 0.19 106.616 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -82.37 143.01 31.53 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.72 -1.238 . . . . 0.2 111.724 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.442 ' C ' ' N ' ' B' ' 69' ' ' VAL . 25.1 m95 -76.25 -13.31 60.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.565 -0.709 . . . . 0.21 109.33 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 39.8 m-20 -55.2 -11.58 0.77 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.865 -1.161 . . . . 0.49 107.865 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.442 ' N ' ' C ' ' B' ' 67' ' ' TRP . 31.2 m -66.71 140.31 19.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 N-CA-C 109.313 -0.625 . . . . 1.04 109.313 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -59.96 -39.51 85.85 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.313 -0.867 . . . . 1.36 109.245 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.118 -1.593 . . . . 2.32 109.118 179.537 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.149 0.5 . . . . 2.88 109.756 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t -99.65 142.6 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.332 0 O-C-N 121.235 -0.915 . . . . 0.45 109.292 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -130.84 127.16 38.04 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.182 -0.949 . . . . 1.67 109.476 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -95.27 124.73 39.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.242 -0.911 . . . . 0.31 109.301 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mm -101.47 116.39 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.288 -1.004 . . . . 0.19 108.288 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -98.55 -3.54 36.16 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.009 -1.057 . . . . 2.25 109.721 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -152.26 159.93 43.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.863 -1.148 . . . . 0.15 110.975 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -63.98 -34.33 77.75 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.83 -1.174 . . . . 1.65 107.83 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -56.61 -46.22 81.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.49 -0.929 . . . . 0.23 108.49 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.56 -31.0 68.92 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.652 -0.87 . . . . 0.17 108.652 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.537 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.5 t80 -60.03 -43.3 95.4 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.105 -0.997 . . . . 0.14 108.936 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -66.56 -43.19 85.72 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.915 -0.772 . . . . 1.31 108.915 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -62.49 -40.72 97.59 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.583 -0.698 . . . . 1.77 110.622 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.11 -40.33 86.84 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.85 -1.157 . . . . 0.15 108.684 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 11' ' ' PHE . 79.8 mt -60.76 -40.86 94.03 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.17 108.203 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -70.08 -34.5 73.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.318 -0.864 . . . . 1.07 109.592 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.8 75.18 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.643 -0.661 . . . . 0.18 110.202 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.09 71.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.185 -0.947 . . . . 0.17 109.71 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.78 -127.57 25.51 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 110.455 -1.058 . . . . 0.2 110.455 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -90.79 2.42 56.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.918 -1.342 . . . . 1.07 110.307 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.5 mttt -74.05 150.69 40.47 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.005 -1.059 . . . . 1.5 110.011 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.649 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.29 156.45 15.57 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.287 -1.375 . . . . 0.47 107.287 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.649 ' H ' HD23 ' A' ' 22' ' ' LEU . 65.6 t -143.97 111.54 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.75 -1.219 . . . . 0.17 109.483 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.4 t -100.69 141.47 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 108.046 -1.094 . . . . 0.14 108.046 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.9 t -124.64 121.51 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.307 -0.871 . . . . 0.13 109.622 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -98.71 121.13 40.26 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.307 -0.871 . . . . 1.05 109.917 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.24 19.69 11.51 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.963 -1.086 . . . . 0.73 110.129 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.443 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.2 m -54.3 143.29 23.7 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.047 -1.033 . . . . 0.3 110.595 -178.486 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.506 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -81.0 129.43 34.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.031 -1.1 . . . . 0.22 108.031 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -68.62 -32.29 72.06 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.987 -1.07 . . . . 0.3 108.997 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.509 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 54.4 p-90 -73.59 -21.54 60.3 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.598 -0.841 . . . . 0.26 110.803 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.8 t -84.66 113.14 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.099 -1.001 . . . . 0.26 108.594 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.435 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.26 -51.99 55.41 Favored Glycine 0 N--CA 1.486 2.007 0 C-N-CA 120.698 -0.763 . . . . 0.23 111.334 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 33.0 Cg_exo -50.31 -36.31 46.89 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 CA-C-N 119.002 1.401 . . . . 0.31 112.056 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.443 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.88 -46.19 19.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.39 -0.818 . . . . 0.24 109.148 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -59.28 -32.9 70.46 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.08 -1.013 . . . . 1.59 109.003 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.467 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.1 tmm? -59.15 -27.75 65.94 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.635 -0.666 . . . . 2.1 110.133 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.8 mt -83.58 -5.9 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.492 -0.755 . . . . 0.49 110.952 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.545 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.15 -31.56 9.56 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 119.62 -1.925 . . . . 0.8 113.32 -176.959 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.6 Cg_exo -59.68 -40.2 66.87 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 CA-C-N 121.347 1.517 . . . . 0.28 112.129 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.77 -1.172 . . . . 0.37 109.481 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -61.15 -50.63 72.42 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.229 -0.919 . . . . 0.16 109.317 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -67.99 -41.7 81.88 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-O 121.156 0.503 . . . . 0.32 110.974 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.2 m -64.72 -37.76 88.69 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.051 -1.031 . . . . 0.22 110.392 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.54 -23.67 67.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.444 -0.785 . . . . 0.22 110.62 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.9 m -53.14 -39.88 63.83 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.724 -1.235 . . . . 0.16 108.064 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -82.9 -17.77 42.54 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.421 -0.8 . . . . 2.16 109.292 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -75.65 -37.3 59.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.95 -1.5 . . . . 1.78 106.95 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -122.03 68.48 0.93 Allowed 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.977 -1.49 . . . . 0.25 106.977 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -63.59 -11.05 21.64 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.815 -0.809 . . . . 0.22 108.815 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -89.97 8.77 30.72 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.414 -0.958 . . . . 1.13 108.414 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.41 HG13 ' HB3' ' A' ' 22' ' ' LEU . 45.6 t -127.56 146.09 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.355 -0.98 . . . . 0.24 108.355 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -99.96 122.31 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.033 -1.042 . . . . 0.15 109.451 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.534 ' C ' HD12 ' A' ' 55' ' ' LEU . 46.9 m-85 -103.73 127.95 51.15 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.272 -0.892 . . . . 0.12 109.164 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 54' ' ' PHE . 3.8 mp -111.35 139.95 46.34 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.249 -0.907 . . . . 0.22 109.153 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -111.87 129.89 56.01 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 106.828 -1.545 . . . . 1.13 106.828 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.1 t -127.25 139.12 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.608 -0.682 . . . . 0.15 110.851 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.8 t0 -99.22 118.38 35.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.598 -0.89 . . . . 1.05 108.598 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.05 -18.41 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 120.257 -1.527 . . . . 0.16 108.608 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.509 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.8 m-20 -92.27 -43.11 9.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.494 -0.754 . . . . 1.08 111.566 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.458 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.2 m-20 -95.66 -16.66 21.88 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.719 -1.238 . . . . 1.07 108.701 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.1 37.78 4.29 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.632 -1.247 . . . . 0.14 107.632 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -59.93 -20.48 57.66 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 1.47 110.154 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.598 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -66.97 -36.77 82.94 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.969 -1.082 . . . . 1.05 108.464 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.598 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.9 t -72.45 -45.65 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.424 -0.798 . . . . 0.35 109.742 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.87 -36.65 70.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.542 -0.724 . . . . 0.26 111.328 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.1 p -60.47 -37.02 79.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.212 . . . . 0.24 109.184 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.6 -35.48 80.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.495 -0.753 . . . . 2.06 109.369 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -87.27 -1.29 57.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.383 -0.823 . . . . 0.23 110.772 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mp0 54.87 49.87 16.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.215 -0.928 . . . . 2.02 109.846 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.51 135.88 27.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 120.915 -1.116 . . . . 0.16 108.562 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -107.41 -15.46 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.71 -0.619 . . . . 1.6 109.836 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.5 154.49 22.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.897 -1.127 . . . . 0.14 111.333 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.444 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.5 p -124.52 155.7 68.71 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 107.954 -1.128 . . . . 0.15 107.954 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -77.22 141.39 68.53 Favored 'Cis proline' 0 N--CA 1.495 1.567 0 C-N-CA 123.769 -1.346 . . . . 0.16 113.025 -2.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.2 m -125.87 130.73 51.92 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.644 -0.872 . . . . 0.13 108.644 177.804 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -108.77 131.44 54.95 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.759 -0.83 . . . . 0.2 108.759 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.407 HE22 ' HB1' ' A' ' 69' ' ' ALA . 74.9 mt-30 -122.97 143.48 49.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.35 -0.982 . . . . 0.29 108.35 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -109.71 134.11 52.37 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.334 0.588 . . . . 0.14 110.594 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -126.83 148.76 49.95 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.406 -0.59 . . . . 0.15 109.406 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -147.2 127.61 14.02 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.926 -1.138 . . . . 1.68 107.926 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 53.48 33.58 16.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.91 -1.119 . . . . 1.22 108.296 -178.724 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.49 20.17 79.65 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.201 -1.16 . . . . 0.23 110.201 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 38.9 mm-40 -124.07 134.06 53.48 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.351 -1.088 . . . . 2.07 111.088 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -77.9 126.17 30.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.418 -0.801 . . . . 1.82 109.25 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.7 m -124.12 4.35 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.637 -0.664 . . . . 0.3 111.038 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.67 160.63 25.97 Favored Glycine 0 N--CA 1.496 2.669 0 C-N-CA 118.14 -1.981 . . . . 0.17 111.581 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -168.56 148.02 4.41 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 122.088 -0.654 . . . . 1.93 109.882 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -162.06 160.1 27.06 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.277 -0.889 . . . . 0.14 109.118 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -126.1 160.82 29.11 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.486 0.66 . . . . 0.12 109.991 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.471 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.36 143.28 6.44 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.014 -1.635 . . . . 0.12 109.014 179.357 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.4 65.71 3.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.044 -1.268 . . . . 0.18 109.877 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.7 t-20 -118.06 97.07 5.62 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.622 -0.881 . . . . 0.88 108.622 178.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.44 -33.53 73.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.489 -0.757 . . . . 1.06 111.384 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.86 -29.97 71.1 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 1.61 109.239 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -60.53 -36.93 79.6 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-O 121.439 0.638 . . . . 1.45 109.51 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 53.9 mt -57.82 -39.75 78.38 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 122.084 0.945 . . . . 0.19 108.499 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -60.98 -43.43 98.82 Favored 'General case' 0 C--N 1.289 -2.047 0 C-N-CA 119.904 -0.718 . . . . 2.1 110.879 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.28 -43.86 76.81 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.206 -0.934 . . . . 0.19 111.507 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.5 m -65.3 -40.3 93.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.709 -1.244 . . . . 0.2 109.706 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.95 -49.58 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 N-CA-C 108.196 -1.039 . . . . 0.16 108.196 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.468 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.3 t-20 -60.29 -36.04 76.94 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.923 0.868 . . . . 0.95 108.678 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -67.44 -39.98 85.42 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.808 -0.558 . . . . 2.21 110.091 -178.723 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 22' ' ' LEU . 87.7 mt -100.88 2.61 41.09 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.299 -0.875 . . . . 0.25 111.17 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.7 p . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.423 -1.423 . . . . 1.08 109.263 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 N--CA 1.494 1.537 0 CA-C-O 121.195 0.415 . . . . 1.46 112.272 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -97.47 119.82 36.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.504 -0.748 . . . . 0.88 109.084 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.414 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.9 m -104.76 129.95 52.92 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.513 -0.742 . . . . 0.7 109.023 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -65.49 -30.91 71.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.354 -0.842 . . . . 0.61 109.095 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.414 ' H ' HG22 ' B' ' 61' ' ' THR . 69.5 mmtt -63.28 -21.24 66.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.26 -0.9 . . . . 1.31 110.407 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.471 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.5 mm -129.91 139.91 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.672 -0.643 . . . . 0.15 109.424 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.0 m -101.03 132.05 46.63 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 106.88 -1.526 . . . . 0.19 106.88 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m -83.93 140.01 32.22 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.603 -1.311 . . . . 0.2 111.219 -177.817 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.444 ' NE1' HG23 ' A' ' 74' ' ' THR . 20.6 m95 -73.15 -8.65 56.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.223 -0.923 . . . . 0.21 109.921 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 47.2 m-20 -55.29 -11.65 0.82 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.949 -1.095 . . . . 0.49 108.917 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.413 HG11 ' CH2' ' A' ' 31' ' ' TRP . 16.8 m -60.23 139.18 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.238 -0.914 . . . . 1.04 109.21 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -59.99 -40.38 88.97 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.193 -0.942 . . . . 1.36 109.174 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.037 0 N-CA-C 109.016 -1.634 . . . . 2.32 109.016 -179.694 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.9 mmm . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.389 -0.596 . . . . 2.88 109.389 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.424 HG21 ' ND1' ' A' ' 43' ' ' HIS . 63.1 t -99.03 136.32 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.466 -0.771 . . . . 0.45 109.104 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -131.18 129.94 42.36 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.243 -0.911 . . . . 1.67 108.796 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -98.72 124.1 43.35 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 0.31 108.884 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -102.8 115.08 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 108.666 -0.864 . . . . 0.19 108.666 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -97.79 -0.05 45.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.16 -0.962 . . . . 2.25 110.173 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.12 154.22 34.36 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.869 -1.144 . . . . 0.15 111.01 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -63.64 -32.39 73.85 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.175 -1.046 . . . . 1.65 108.175 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 47.6 m -57.24 -48.43 78.85 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.179 -1.008 . . . . 0.23 108.596 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.75 -31.01 69.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.36 -0.837 . . . . 0.17 109.163 178.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.529 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.1 t80 -59.45 -44.03 93.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.159 -0.963 . . . . 0.14 109.006 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -65.56 -40.88 93.33 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.705 -0.85 . . . . 1.31 108.705 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.34 -37.12 86.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.555 -0.716 . . . . 1.77 110.327 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.76 -42.34 81.91 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.327 -0.858 . . . . 0.15 109.054 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.529 HD11 ' CE2' ' A' ' 11' ' ' PHE . 55.0 mt -60.73 -40.35 92.04 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.609 -0.885 . . . . 0.17 108.609 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -70.04 -38.5 75.85 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.632 -0.667 . . . . 1.07 110.275 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.3 -37.38 80.58 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.254 -0.904 . . . . 0.18 109.988 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.85 69.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.204 -0.935 . . . . 0.17 109.303 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.03 -127.28 30.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.931 -1.268 . . . . 0.2 109.931 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -89.92 1.34 56.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.263 -1.139 . . . . 1.07 110.689 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttt -73.34 150.0 42.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.788 -1.195 . . . . 1.5 109.493 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.674 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.48 156.29 16.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 107.472 -1.307 . . . . 0.47 107.472 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.674 ' H ' HD23 ' A' ' 22' ' ' LEU . 84.4 t -143.34 111.33 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.132 -0.98 . . . . 0.17 108.992 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.89 140.57 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.135 -1.061 . . . . 0.14 108.135 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.53 123.96 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.325 -0.859 . . . . 0.13 109.249 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.523 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 27.4 t70 -102.32 118.43 36.87 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.465 -0.772 . . . . 1.05 109.692 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -95.42 23.15 6.18 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.197 -0.939 . . . . 0.73 109.974 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.1 m -59.13 145.7 41.47 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.742 -1.224 . . . . 0.3 110.078 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.724 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.74 126.87 32.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 107.957 -1.127 . . . . 0.22 107.957 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 t -68.08 -30.14 69.25 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.263 -1.014 . . . . 0.3 108.263 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.724 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.1 p-90 -76.44 -15.03 60.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.488 -0.757 . . . . 0.26 110.624 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.16 121.05 28.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.809 -1.182 . . . . 0.26 108.378 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -64.66 -53.62 33.83 Favored Glycine 0 N--CA 1.495 2.58 0 O-C-N 121.542 -0.724 . . . . 0.23 112.698 -177.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.5 Cg_endo -61.11 -29.92 88.16 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 CA-C-N 119.349 1.575 . . . . 0.31 112.279 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.22 17.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.155 -0.966 . . . . 0.24 109.442 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -59.75 -30.84 69.13 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.067 -1.021 . . . . 1.59 109.111 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' A' ' 37' ' ' MET . 13.8 tmm? -59.69 -28.4 67.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.643 -0.661 . . . . 2.1 109.498 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.6 mt -81.48 -4.13 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 O-C-N 121.545 -0.722 . . . . 0.49 111.179 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.21 -31.95 10.49 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 119.982 -1.699 . . . . 0.8 113.528 -177.063 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.9 Cg_exo -59.09 -39.84 75.99 Favored 'Trans proline' 0 N--CA 1.494 1.529 0 CA-C-N 121.387 1.531 . . . . 0.28 113.244 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -69.12 -49.22 59.03 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.504 -1.372 . . . . 0.37 108.849 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -59.99 -51.22 70.57 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.728 -0.842 . . . . 0.16 108.728 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.424 ' ND1' HG21 ' A' ' 2' ' ' VAL . 46.3 t60 -66.11 -44.14 85.16 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.897 -0.502 . . . . 0.32 110.985 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.5 m -63.24 -39.98 96.13 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.828 -1.17 . . . . 0.22 110.722 -179.322 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.02 -23.9 65.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.194 -0.941 . . . . 0.22 110.596 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -52.14 -40.19 61.01 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.84 -1.163 . . . . 0.16 108.602 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -84.66 -15.33 45.75 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.316 -0.865 . . . . 2.16 109.569 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -76.97 -38.08 53.95 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 107.502 -1.296 . . . . 1.78 107.502 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -121.64 68.0 0.91 Allowed 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 106.671 -1.603 . . . . 0.25 106.671 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 p -63.22 -9.88 13.18 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.384 -0.969 . . . . 0.22 108.384 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -90.23 9.75 27.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.129 -1.063 . . . . 1.13 108.129 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.3 t -127.85 143.94 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.861 -1.163 . . . . 0.24 107.861 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.6 mm -99.95 120.58 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 120.994 -1.066 . . . . 0.15 109.483 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.575 ' C ' HD12 ' A' ' 55' ' ' LEU . 51.9 m-85 -103.3 126.06 50.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.181 -0.949 . . . . 0.12 109.816 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.575 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -110.09 144.49 38.62 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.257 -0.902 . . . . 0.22 110.045 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -112.97 131.48 55.73 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.24 -1.393 . . . . 1.13 107.24 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.5 t -129.5 132.81 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.277 -0.89 . . . . 0.15 110.409 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.469 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 51.7 t0 -94.58 120.05 34.21 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.376 -0.827 . . . . 1.05 109.308 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.6 m -66.55 -18.17 23.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.478 -1.389 . . . . 0.16 108.156 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 16.1 m-20 -93.29 -44.79 8.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.441 -0.787 . . . . 1.08 112.264 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.443 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 78.9 m-20 -94.83 -13.61 25.38 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.554 -1.341 . . . . 1.07 108.91 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.4 37.88 4.31 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.542 -1.281 . . . . 0.14 107.542 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -60.12 -20.9 60.55 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.772 -0.58 . . . . 1.47 109.496 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.655 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -62.64 -36.96 84.51 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.929 -1.107 . . . . 1.05 108.473 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.655 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.4 t -73.31 -42.11 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.299 -0.876 . . . . 0.35 109.112 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.7 -41.43 79.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.392 -0.818 . . . . 0.26 111.083 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -59.99 -37.94 81.13 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.983 -1.073 . . . . 0.24 109.666 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -66.61 -37.93 85.92 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 2.06 109.507 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.56 -3.73 58.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.159 -0.963 . . . . 0.23 110.948 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 54.05 49.88 17.87 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.984 -1.073 . . . . 2.02 110.541 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.85 131.69 30.64 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.723 -1.236 . . . . 0.16 108.999 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -102.45 -10.73 19.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.572 -0.705 . . . . 1.6 110.655 -179.168 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.504 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.97 154.27 17.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.607 -1.308 . . . . 0.14 111.136 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.409 HG23 ' NE1' ' B' ' 67' ' ' TRP . 34.4 p -127.36 154.12 77.17 Favored Pre-proline 0 N--CA 1.502 2.147 0 N-CA-C 107.585 -1.265 . . . . 0.15 107.585 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -75.97 141.64 71.25 Favored 'Cis proline' 0 N--CA 1.497 1.718 0 C-N-CA 124.172 -1.179 . . . . 0.16 113.006 -1.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 91.5 m -126.98 132.29 50.84 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 121.657 0.742 . . . . 0.13 109.26 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.701 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.2 m-85 -109.0 130.24 55.47 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.779 -0.823 . . . . 0.2 108.779 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -122.16 140.35 52.67 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.615 -0.883 . . . . 0.29 108.615 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -107.9 134.86 50.22 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.398 0.618 . . . . 0.14 110.186 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -129.19 146.04 51.2 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.288 0.566 . . . . 0.15 109.56 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -145.46 134.89 23.13 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 107.283 -1.376 . . . . 1.68 107.283 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.8 mttt 50.06 33.36 6.81 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.923 -1.11 . . . . 1.22 109.014 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.98 25.68 74.22 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.58 -1.408 . . . . 0.23 109.58 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 45.4 mm-40 -129.14 132.78 47.4 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.465 -1.02 . . . . 2.07 110.989 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.1 122.89 26.8 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.083 -0.71 . . . . 1.82 109.083 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.0 m -123.35 8.33 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.698 . . . . 0.3 110.433 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.44 153.86 14.35 Favored Glycine 0 N--CA 1.495 2.578 0 C-N-CA 118.344 -1.884 . . . . 0.17 111.82 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -166.05 149.11 7.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 122.033 -0.686 . . . . 1.93 109.56 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.43 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 19.9 p90 -163.66 163.66 24.22 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.279 -0.968 . . . . 0.14 109.339 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.91 160.34 31.3 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.504 0.669 . . . . 0.12 110.191 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.2 141.69 5.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.594 -1.402 . . . . 0.12 109.594 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.27 65.41 2.85 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.288 -1.125 . . . . 0.18 109.347 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.8 t-20 -118.55 93.95 4.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.587 -0.894 . . . . 0.88 108.587 179.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.47 74.65 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.273 -0.892 . . . . 1.06 111.494 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.84 -29.79 70.95 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.758 -1.214 . . . . 1.61 109.307 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.43 ' NZ ' ' CD2' ' A' ' 89' ' ' PHE . 56.5 tttm -61.11 -34.75 75.46 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.558 -0.714 . . . . 1.45 109.215 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.701 HD21 ' CD1' ' A' ' 77' ' ' PHE . 38.6 mt -58.92 -38.91 80.03 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.967 -1.123 . . . . 0.19 107.967 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -61.93 -42.54 99.21 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.906 -0.718 . . . . 2.1 110.966 -178.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.75 -43.8 75.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.003 -1.061 . . . . 0.19 111.717 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.4 m -65.65 -39.63 91.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.694 -1.254 . . . . 0.2 110.055 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -60.92 -49.15 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.921 -1.112 . . . . 0.16 108.73 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 105' ' ' VAL . 21.6 t-20 -60.5 -35.52 76.13 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.151 -1.055 . . . . 0.95 108.151 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -67.45 -39.94 85.39 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 115.973 -0.558 . . . . 2.21 110.143 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.6 mt -99.23 -1.46 39.12 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.172 -0.955 . . . . 0.25 111.344 -178.858 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 102' ' ' ASN . 4.9 p . . . . . 0 N--CA 1.498 1.97 0 O-C-N 120.49 -1.381 . . . . 1.08 109.426 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo . . . . . 0 N--CA 1.493 1.454 0 CA-C-O 120.81 0.254 . . . . 1.46 112.687 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.48 125.78 38.27 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.87 -1.144 . . . . 0.88 109.279 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.414 ' O ' ' O ' ' B' ' 64' ' ' ILE . 51.3 m -107.11 129.86 54.77 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.467 -0.77 . . . . 0.7 108.962 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.97 -31.27 70.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.61 109.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.411 ' H ' HG22 ' B' ' 61' ' ' THR . 41.1 mmtm -63.06 -19.97 64.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.508 -0.745 . . . . 1.31 109.459 -179.456 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.445 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.6 mm -129.56 140.0 50.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.843 -0.535 . . . . 0.15 109.732 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -98.06 127.33 43.94 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 106.525 -1.658 . . . . 0.19 106.525 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.0 m -80.79 145.2 31.58 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.833 -1.167 . . . . 0.2 110.755 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.504 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.0 m95 -77.39 -9.94 59.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.133 -0.979 . . . . 0.21 108.815 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 42.4 m-20 -51.95 -12.19 0.2 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.355 -0.841 . . . . 0.49 108.762 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.457 ' N ' ' C ' ' B' ' 67' ' ' TRP . 11.9 m -61.61 139.0 21.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 C-N-CA 119.226 -0.99 . . . . 1.04 109.181 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.25 -38.37 83.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.32 -0.863 . . . . 1.36 109.409 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 N-CA-C 109.398 -1.481 . . . . 2.32 109.398 -179.678 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.3 mmm . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.43 0.633 . . . . 2.88 109.664 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.3 t -98.79 133.02 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.454 -0.779 . . . . 0.45 109.956 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -129.92 129.47 43.91 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.345 -0.983 . . . . 1.67 108.345 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.532 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 65.4 tt0 -96.75 124.26 40.68 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.421 -0.799 . . . . 0.31 108.944 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.8 mm -102.65 117.1 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 108.505 -0.924 . . . . 0.19 108.505 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.532 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 64.4 mm-40 -99.72 -2.51 35.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.289 -0.882 . . . . 2.25 109.888 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -155.15 157.27 37.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.185 -0.947 . . . . 0.15 111.115 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.191 -1.04 . . . . 1.65 108.191 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.4 m -55.84 -48.4 75.57 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.354 -0.938 . . . . 0.23 109.191 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.72 -30.33 67.93 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.254 -0.904 . . . . 0.17 109.218 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.5 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.3 t80 -58.88 -44.26 91.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.326 -0.859 . . . . 0.14 109.38 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -64.81 -42.31 95.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.308 -0.87 . . . . 1.31 109.151 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.534 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.55 -39.58 94.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.753 -0.592 . . . . 1.77 110.451 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.99 -41.1 87.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.234 -0.917 . . . . 0.15 109.12 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.5 HD11 ' CE2' ' A' ' 11' ' ' PHE . 77.8 mt -60.58 -40.42 91.67 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 108.11 -1.07 . . . . 0.17 108.11 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -69.09 -35.99 77.09 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.353 0.597 . . . . 1.07 110.416 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.4 79.58 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.271 -0.893 . . . . 0.18 109.541 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.15 -34.6 73.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.363 -0.836 . . . . 0.17 109.799 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.21 -125.65 21.66 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 110.019 -1.232 . . . . 0.2 110.019 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -90.86 2.41 56.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.237 -1.155 . . . . 1.07 110.462 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -73.83 151.83 40.42 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.93 -1.106 . . . . 1.5 109.622 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.671 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.52 158.16 18.65 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 106.811 -1.552 . . . . 0.47 106.811 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.671 ' H ' HD23 ' A' ' 22' ' ' LEU . 57.8 t -145.62 123.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.987 -1.07 . . . . 0.17 108.743 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -112.2 140.25 32.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 108.483 -0.932 . . . . 0.14 108.483 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.7 t -123.44 119.99 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.358 -0.838 . . . . 0.13 109.499 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -97.42 119.75 36.54 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.306 -0.871 . . . . 1.05 110.038 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -96.52 25.26 5.21 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.955 -1.091 . . . . 0.73 110.175 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.524 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.4 m -59.89 147.33 38.91 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 120.954 -1.091 . . . . 0.3 110.773 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.577 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.48 126.53 32.87 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.772 -1.196 . . . . 0.22 107.772 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.5 -33.97 76.19 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.024 -1.102 . . . . 0.3 108.024 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.577 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 59.7 p-90 -71.35 -26.63 62.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.447 -0.783 . . . . 0.26 110.686 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.6 t -80.7 112.9 18.51 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.834 -1.172 . . . . 0.26 107.834 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.469 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.36 -51.22 60.09 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 111.274 -0.73 . . . . 0.23 111.274 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -49.84 -37.87 46.41 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.754 1.277 . . . . 0.31 111.318 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.524 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -75.37 -46.98 29.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.191 -0.943 . . . . 0.24 108.913 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -59.74 -30.15 68.64 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.626 -0.879 . . . . 1.59 108.626 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 12.4 tpt -59.67 -30.19 68.58 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.601 -0.687 . . . . 2.1 110.14 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.443 HD11 ' HB1' ' A' ' 92' ' ' ALA . 6.3 mt -83.58 -4.79 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.695 -0.628 . . . . 0.49 110.756 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.548 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.54 -31.94 10.21 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.803 -1.81 . . . . 0.8 113.236 -176.836 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -57.91 -38.96 90.35 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 CA-C-N 121.487 1.567 . . . . 0.28 111.914 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -71.79 -51.23 23.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.146 -0.971 . . . . 0.37 108.985 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.44 -48.04 82.01 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.16 -0.962 . . . . 0.16 108.613 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -68.62 -41.24 79.77 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.567 -0.708 . . . . 0.32 110.746 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 58.7 m -63.82 -37.21 86.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.997 -1.064 . . . . 0.22 109.952 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.1 mt -62.29 -27.82 69.29 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.108 -0.995 . . . . 0.22 110.649 -178.649 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.2 m -51.73 -38.02 53.5 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 120.873 -1.142 . . . . 0.16 109.03 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -87.02 -15.7 37.88 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.12 -0.987 . . . . 2.16 109.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -79.02 -37.94 37.82 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.625 -1.297 . . . . 1.78 107.709 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -120.32 65.93 0.83 Allowed 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 106.857 -1.534 . . . . 0.25 106.857 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.4 p -62.93 -8.11 6.51 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 108.625 -0.88 . . . . 0.22 108.625 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -91.02 4.44 52.08 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.957 -0.757 . . . . 1.13 108.957 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.503 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.0 t -124.29 147.84 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.078 -1.453 . . . . 0.24 107.078 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.17 123.5 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 120.956 -1.09 . . . . 0.15 109.248 -178.42 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.579 ' C ' HD12 ' A' ' 55' ' ' LEU . 52.4 m-85 -103.94 126.87 51.38 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.35 -0.844 . . . . 0.12 110.039 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.579 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.4 mp -111.98 141.76 45.23 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 121.281 -0.887 . . . . 0.22 109.518 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -111.82 132.27 54.79 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 107.313 -1.366 . . . . 1.13 107.313 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.88 135.68 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.268 -0.895 . . . . 0.15 110.486 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 45.3 t0 -98.48 120.61 39.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.444 -0.785 . . . . 1.05 109.121 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.21 -19.6 25.92 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 O-C-N 120.643 -1.286 . . . . 0.16 108.404 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.525 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.0 m-20 -93.05 -41.65 9.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.521 -0.737 . . . . 1.08 111.812 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -95.54 -16.66 22.01 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.645 -1.284 . . . . 1.07 108.659 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.71 39.06 4.05 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.777 -1.194 . . . . 0.14 107.777 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.11 -19.99 56.07 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.753 -0.592 . . . . 1.47 109.938 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.581 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -65.03 -36.55 84.74 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.073 -1.017 . . . . 1.05 108.877 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.581 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -72.73 -42.44 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 108.409 -0.96 . . . . 0.35 108.409 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.04 -40.66 82.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.608 -0.683 . . . . 0.26 110.568 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.6 p -60.23 -40.29 89.71 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.761 -1.175 . . . . 0.24 109.577 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -66.2 -39.38 89.61 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 2.06 109.175 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.419 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.52 -4.68 59.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.152 -0.968 . . . . 0.23 110.739 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 53.77 49.98 18.01 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.852 -1.155 . . . . 2.02 109.887 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.6 t -65.01 130.46 30.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 C-N-CA 118.425 -1.31 . . . . 0.16 108.375 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -103.05 -11.07 18.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.576 -0.702 . . . . 1.6 110.694 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.495 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.25 155.81 23.2 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.599 -1.313 . . . . 0.14 110.605 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.1 p -129.44 153.63 80.63 Favored Pre-proline 0 N--CA 1.501 2.1 0 N-CA-C 108.148 -1.056 . . . . 0.15 108.148 178.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -76.59 143.33 75.75 Favored 'Cis proline' 0 N--CA 1.489 1.259 0 C-N-CA 123.613 -1.411 . . . . 0.16 112.667 -2.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.3 m -127.85 135.0 49.44 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.23 -1.026 . . . . 0.13 108.23 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -113.32 131.84 55.8 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.966 -0.753 . . . . 0.2 108.966 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.419 HE22 ' HB1' ' A' ' 69' ' ' ALA . 69.6 mt-30 -120.44 141.86 49.76 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.283 -1.006 . . . . 0.29 108.283 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -108.03 134.8 50.42 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.472 0.653 . . . . 0.14 110.226 -179.23 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -128.64 147.11 50.71 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 109.176 -0.675 . . . . 0.15 109.176 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -149.62 125.29 10.39 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.788 -1.19 . . . . 1.68 107.788 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 59.74 30.2 19.78 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 107.787 -1.19 . . . . 1.22 107.787 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.1 14.91 81.8 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.713 -1.355 . . . . 0.23 109.713 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.0 mm100 -116.89 135.64 53.56 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.546 -0.973 . . . . 2.07 110.91 -178.98 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -78.98 123.88 27.72 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.695 -0.854 . . . . 1.82 108.695 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.2 m -123.8 7.61 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.472 -0.768 . . . . 0.3 111.439 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.95 156.13 17.22 Favored Glycine 0 N--CA 1.498 2.819 0 C-N-CA 118.426 -1.845 . . . . 0.17 111.513 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -164.71 149.17 9.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.872 -0.781 . . . . 1.93 109.353 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.447 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 7.0 p90 -163.86 159.44 21.09 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.635 -0.826 . . . . 0.14 109.78 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.6 p -127.37 160.65 30.76 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.595 0.712 . . . . 0.12 109.924 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.476 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.22 140.6 5.7 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.17 -1.572 . . . . 0.12 109.17 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.443 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.28 67.27 2.5 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.219 -1.165 . . . . 0.18 109.146 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.7 t-20 -120.37 95.09 4.59 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.548 -0.908 . . . . 0.88 108.548 178.864 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -34.76 77.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.141 -0.975 . . . . 1.06 111.403 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.97 -28.71 70.27 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.077 -1.015 . . . . 1.61 109.412 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.84 -34.64 76.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.331 -0.856 . . . . 1.45 108.836 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.46 -38.69 81.44 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.218 -1.03 . . . . 0.19 108.218 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -63.16 -43.4 98.41 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 119.845 -0.742 . . . . 2.1 110.46 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -44.0 77.33 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 0.19 111.143 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.9 m -65.37 -39.67 92.6 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.973 -1.079 . . . . 0.2 110.706 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.01 -48.36 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.067 -1.02 . . . . 0.16 108.267 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 105' ' ' VAL . 26.0 t-20 -60.5 -34.75 74.52 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.194 -1.039 . . . . 0.95 108.194 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.9 tt0 -67.93 -39.89 83.44 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.548 -0.72 . . . . 2.21 110.63 -178.488 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.655 ' HB2' HD11 ' A' ' 22' ' ' LEU . 86.2 mt -100.68 0.28 38.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.226 -0.922 . . . . 0.25 111.273 -178.802 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.8 p . . . . . 0 N--CA 1.497 1.905 0 O-C-N 120.569 -1.332 . . . . 1.08 108.992 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 N--CA 1.495 1.572 0 CA-C-O 121.169 0.404 . . . . 1.46 112.291 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -98.12 121.36 39.95 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.185 -0.947 . . . . 0.88 109.401 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.439 ' O ' ' O ' ' B' ' 64' ' ' ILE . 25.2 m -107.51 131.85 53.88 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.441 -0.787 . . . . 0.7 109.543 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 55.5 mt -64.49 -31.47 72.7 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.218 -0.926 . . . . 0.61 109.473 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.419 ' H ' HG22 ' B' ' 61' ' ' THR . 26.8 mmtp -64.69 -16.54 63.02 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.847 -0.797 . . . . 1.31 108.847 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.476 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.7 mm -126.34 139.97 50.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 109.372 -0.603 . . . . 0.15 109.372 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 5.0 m -96.45 127.98 42.96 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 106.54 -1.652 . . . . 0.19 106.54 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 66' ' ' SER . . . . . 0.43 ' O ' HG12 ' B' ' 69' ' ' VAL . 54.3 m -78.89 144.25 35.09 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.852 -1.155 . . . . 0.2 110.554 -178.204 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.442 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.8 m95 -79.62 -14.62 58.68 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.21 109.056 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 25.6 m-20 -57.42 -11.66 2.05 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.788 -1.19 . . . . 0.49 107.788 179.14 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.53 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.7 p -64.12 136.93 25.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 O-C-N 121.682 -0.636 . . . . 1.04 109.322 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -60.46 -38.42 84.14 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 1.36 108.622 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 71' ' ' GLY . . . . . 0.53 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.337 0 CA-C-O 117.93 -1.483 . . . . 2.32 109.695 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.307 0.575 . . . . 2.88 109.546 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.449 HG12 ' N ' ' A' ' 3' ' ' LYS . 61.5 t -98.96 159.53 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 0.45 109.539 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.449 ' N ' HG12 ' A' ' 2' ' ' VAL . 21.6 tptm -129.96 130.02 44.52 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.782 -0.821 . . . . 1.67 108.782 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -97.01 124.03 40.88 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.867 -0.79 . . . . 0.31 108.867 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.2 mm -102.15 115.83 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 108.17 -1.048 . . . . 0.19 108.17 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -99.68 0.14 41.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.333 -0.854 . . . . 2.25 109.619 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.2 155.15 37.21 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.146 -0.971 . . . . 0.15 110.929 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.599 ' HA ' HG22 ' A' ' 65' ' ' VAL . 4.3 ttpm? -65.26 -32.85 74.72 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.765 -1.198 . . . . 1.65 107.765 177.916 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.444 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 46.5 m -58.71 -46.98 86.12 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.215 -1.031 . . . . 0.23 108.215 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.24 -31.76 70.53 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.37 -0.831 . . . . 0.17 108.837 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.559 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.2 t80 -59.81 -43.71 94.37 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.14 109.15 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -64.45 -44.01 92.47 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.584 -0.847 . . . . 1.31 108.796 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.44 -41.1 98.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.565 -0.709 . . . . 1.77 110.723 179.301 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.76 -42.17 95.34 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.252 -0.905 . . . . 0.15 109.285 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.559 HD11 ' CE2' ' A' ' 11' ' ' PHE . 87.1 mt -59.85 -39.86 86.62 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.089 -1.007 . . . . 0.17 108.418 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.41 -34.67 74.81 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.592 -0.693 . . . . 1.07 110.476 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.02 80.9 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.18 110.591 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.21 -30.97 69.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.127 -0.983 . . . . 0.17 110.067 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.95 -125.7 25.42 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.171 -1.172 . . . . 0.2 110.171 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -90.7 3.49 54.1 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -1.143 . . . . 1.07 109.964 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -75.63 148.55 38.67 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 1.5 109.892 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.698 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.54 157.78 16.51 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.667 -1.234 . . . . 0.47 107.667 179.306 . . . . . . . . 3 3 . 1 . 005 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.698 ' H ' HD23 ' A' ' 22' ' ' LEU . 46.9 t -147.01 118.07 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 120.903 -1.123 . . . . 0.17 108.884 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 139.48 27.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.378 -0.971 . . . . 0.14 108.378 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.5 t -123.02 122.62 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.135 -0.978 . . . . 0.13 110.081 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -98.21 119.7 37.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.441 -0.787 . . . . 1.05 109.919 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -96.38 24.46 5.79 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.068 -1.02 . . . . 0.73 109.886 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.436 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.7 m -58.64 146.94 34.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.3 110.077 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.678 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.55 122.92 30.37 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.926 -1.139 . . . . 0.22 107.926 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 t -67.28 -30.26 70.08 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 118.962 -1.095 . . . . 0.3 108.088 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.678 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 52.1 p-90 -71.45 -27.0 62.96 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.441 -0.787 . . . . 0.26 110.885 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.6 t -83.79 120.49 26.1 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.109 -1.071 . . . . 0.26 108.109 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -62.37 -52.1 51.69 Favored Glycine 0 N--CA 1.489 2.2 0 C-N-CA 119.846 -1.169 . . . . 0.23 111.042 -178.516 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.4 Cg_exo -52.15 -34.58 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.702 1.251 . . . . 0.31 112.59 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.436 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.96 -53.77 7.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.91 . . . . 0.24 110.276 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -60.0 -37.37 79.48 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.803 -1.185 . . . . 1.59 109.701 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.525 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.0 tmm? -58.46 -27.98 64.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.148 -0.97 . . . . 2.1 109.342 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.4 mt -87.01 -12.07 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.599 -0.688 . . . . 0.49 112.051 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 29.6 pttt -67.44 -30.53 3.03 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 120.062 -1.649 . . . . 0.8 113.511 -177.504 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.8 Cg_exo -49.79 -36.78 43.43 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 121.803 1.68 . . . . 0.28 112.215 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -67.79 -44.13 78.09 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.384 -1.71 . . . . 0.37 106.384 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.35 -52.45 65.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.946 . . . . 0.16 110.101 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -67.62 -40.11 84.68 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.49 -0.757 . . . . 0.32 109.928 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 70.3 m -61.17 -39.58 90.7 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.381 -0.824 . . . . 0.22 110.567 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.2 mt -62.36 -19.58 63.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.45 -0.781 . . . . 0.22 110.707 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -55.4 -37.12 67.18 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.593 -1.317 . . . . 0.16 108.471 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -82.73 -19.8 37.22 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.509 -0.744 . . . . 2.16 109.103 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -76.62 -37.36 56.5 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.91 -1.144 . . . . 1.78 107.91 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -123.69 67.12 1.02 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.136 -1.431 . . . . 0.25 107.136 177.879 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 80.2 p -63.44 -10.05 15.47 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.42 0.629 . . . . 0.22 109.573 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -91.02 10.43 26.69 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.215 -1.031 . . . . 1.13 108.215 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 22' ' ' LEU . 48.2 t -128.52 148.21 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 108.353 -0.98 . . . . 0.24 108.353 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.443 HG22 ' CD1' ' A' ' 55' ' ' LEU . 30.0 mm -98.79 123.95 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.129 -0.982 . . . . 0.15 109.688 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.505 ' C ' HD12 ' A' ' 55' ' ' LEU . 65.7 m-85 -108.43 123.86 49.52 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.354 -0.841 . . . . 0.12 109.246 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.505 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.9 mp -110.26 144.81 38.41 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 120.906 -1.121 . . . . 0.22 110.136 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -112.54 129.73 56.26 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 106.577 -1.638 . . . . 1.13 106.577 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.4 t -126.46 135.54 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.19 -0.944 . . . . 0.15 110.63 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.696 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.2 t0 -94.47 119.66 33.51 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.738 -0.838 . . . . 1.05 108.738 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.2 m -69.16 -18.52 22.85 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 C-N-CA 118.638 -1.225 . . . . 0.16 108.453 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.8 m-20 -93.01 -42.68 9.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.45 -0.781 . . . . 1.08 111.343 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.484 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 81.3 m-20 -93.92 -15.26 25.13 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.623 -1.298 . . . . 1.07 108.098 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.4 38.39 4.16 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 107.684 -1.228 . . . . 0.14 107.684 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.8 pt20 -59.56 -22.63 61.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 1.47 109.8 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 4.8 p-10 -66.07 -42.9 88.81 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.104 -0.997 . . . . 1.05 108.766 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.599 HG22 ' HA ' ' A' ' 8' ' ' LYS . 21.2 t -68.72 -44.01 82.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 O-C-N 121.328 -0.858 . . . . 0.35 109.88 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.81 72.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.215 -0.928 . . . . 0.26 110.324 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.8 p -61.6 -31.66 71.74 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.045 -1.034 . . . . 0.24 108.711 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -63.81 -40.16 95.97 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.445 -0.785 . . . . 2.06 109.398 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.403 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -88.69 1.39 55.19 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.461 -0.774 . . . . 0.23 110.923 -179.182 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 54.49 50.83 15.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.991 -1.068 . . . . 2.02 109.246 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.1 t -64.35 129.16 27.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 C-N-CA 118.261 -1.376 . . . . 0.16 107.939 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -101.71 -12.71 18.16 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.65 -0.656 . . . . 1.6 109.904 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.47 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.58 156.93 21.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.98 -1.075 . . . . 0.14 110.7 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -129.38 154.62 80.71 Favored Pre-proline 0 N--CA 1.501 2.103 0 N-CA-C 108.184 -1.043 . . . . 0.15 108.184 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -75.0 142.02 73.51 Favored 'Cis proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.841 -1.316 . . . . 0.16 113.439 -1.562 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -126.31 132.19 51.68 Favored 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.521 -0.918 . . . . 0.13 108.521 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.598 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.5 m-85 -111.39 127.15 55.57 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.401 -0.962 . . . . 0.2 108.401 -178.935 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.403 HE22 ' CB ' ' A' ' 69' ' ' ALA . 76.6 mt-30 -119.5 141.48 49.15 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.149 -0.969 . . . . 0.29 108.898 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.405 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 70.8 m-85 -107.8 132.21 53.64 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.198 0.523 . . . . 0.14 110.177 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -125.63 146.3 49.77 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.553 0.692 . . . . 0.15 109.499 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -146.69 129.78 16.46 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.622 -1.251 . . . . 1.68 107.622 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 53.34 31.99 12.89 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.108 -0.995 . . . . 1.22 109.76 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.36 19.78 77.83 Favored Glycine 0 N--CA 1.491 2.321 0 O-C-N 120.954 -1.091 . . . . 0.23 110.879 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -128.77 139.79 52.03 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.311 -1.111 . . . . 2.07 110.378 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -81.3 127.83 33.16 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.196 -0.94 . . . . 1.82 109.506 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.2 m -123.94 9.74 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.608 -0.683 . . . . 0.3 110.283 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.97 151.14 9.68 Favored Glycine 0 N--CA 1.5 2.952 0 C-N-CA 118.719 -1.705 . . . . 0.17 111.713 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -166.06 148.92 7.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.621 -0.929 . . . . 1.93 109.806 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -163.72 162.93 24.25 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.598 -0.841 . . . . 0.14 108.81 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.7 p -126.74 159.92 32.34 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.351 -0.611 . . . . 0.12 109.351 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.487 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.4 143.37 6.16 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.834 -1.306 . . . . 0.12 109.834 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.42 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.58 65.12 2.34 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.15 -1.206 . . . . 0.18 110.098 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 47.1 t-20 -119.46 94.0 4.27 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 107.936 -1.135 . . . . 0.88 107.936 178.334 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -33.15 73.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.079 -1.013 . . . . 1.06 111.303 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 -63.41 -30.18 71.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.943 -1.098 . . . . 1.61 109.291 179.949 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -60.73 -33.68 73.27 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.167 -0.679 . . . . 1.45 109.167 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.598 HD21 ' CD1' ' A' ' 77' ' ' PHE . 35.8 mt -59.76 -38.95 83.22 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.566 -0.902 . . . . 0.19 108.566 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -62.67 -40.93 98.62 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.095 -0.642 . . . . 2.1 110.992 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.39 -44.1 72.15 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.246 -0.909 . . . . 0.19 112.027 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.55 -38.62 91.64 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.724 -1.235 . . . . 0.2 110.025 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.13 -48.91 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 108.162 -1.051 . . . . 0.16 108.162 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.449 ' O ' HG12 ' A' ' 105' ' ' VAL . 18.1 t-20 -61.0 -34.12 74.32 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.561 -0.903 . . . . 0.95 108.561 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -68.85 -39.86 79.7 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.485 -0.759 . . . . 2.21 110.186 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.566 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.4 mt -100.72 1.45 40.45 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.376 -0.828 . . . . 0.25 111.345 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.8 p . . . . . 0 N--CA 1.499 2.002 0 O-C-N 120.475 -1.391 . . . . 1.08 109.064 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 N--CA 1.493 1.466 0 CA-C-O 121.595 0.581 . . . . 1.46 110.785 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.33 119.89 27.09 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.012 -0.736 . . . . 0.88 109.012 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.42 ' O ' ' O ' ' B' ' 64' ' ' ILE . 23.2 m -111.15 131.43 55.1 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.256 -0.646 . . . . 0.7 109.256 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 90.3 mt -67.53 -30.4 70.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.076 -1.015 . . . . 0.61 109.124 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' H ' HG22 ' B' ' 61' ' ' THR . 70.4 mmtt -64.55 -19.86 65.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.606 -0.684 . . . . 1.31 109.953 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.487 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.1 mm -131.94 140.71 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 N-CA-C 109.716 -0.476 . . . . 0.15 109.716 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 56.4 m -98.63 131.68 44.63 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.817 -1.549 . . . . 0.19 106.817 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 66' ' ' SER . . . . . 0.512 ' O ' HG12 ' B' ' 69' ' ' VAL . 68.7 m -81.18 144.85 31.33 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.629 -1.294 . . . . 0.2 111.372 -178.928 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.444 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.2 m95 -79.62 -13.86 59.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.21 109.106 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -58.5 -11.32 2.82 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.363 -1.347 . . . . 0.49 107.363 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.519 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.1 p -68.27 144.13 14.6 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 108.875 -0.787 . . . . 1.04 108.875 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -60.1 -39.96 87.97 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.176 -0.952 . . . . 1.36 109.315 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 71' ' ' GLY . . . . . 0.519 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.007 -1.441 . . . . 2.32 109.643 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 108.718 -0.845 . . . . 2.88 108.718 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.475 HG12 ' N ' ' A' ' 3' ' ' LYS . 68.8 t -100.88 158.82 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.459 -0.776 . . . . 0.45 109.323 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.475 ' N ' HG12 ' A' ' 2' ' ' VAL . 21.6 tptp -129.98 126.33 37.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.352 -0.843 . . . . 1.67 108.77 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -93.84 121.92 35.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.14 -0.975 . . . . 0.31 109.316 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.3 mm -101.51 117.53 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.492 -0.929 . . . . 0.19 108.492 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -99.1 -1.75 38.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.377 -0.827 . . . . 2.25 109.515 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.26 155.33 36.38 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.825 -1.172 . . . . 0.15 111.542 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -63.61 -32.87 74.47 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.94 -1.133 . . . . 1.65 107.94 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 80.5 m -58.71 -45.89 88.57 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.153 -1.019 . . . . 0.23 108.316 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.86 -31.82 69.86 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.304 -0.873 . . . . 0.17 108.86 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.556 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.5 t80 -59.14 -43.94 92.04 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.007 . . . . 0.14 108.691 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -64.62 -42.67 95.34 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.623 -0.88 . . . . 1.31 108.623 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.08 -36.85 85.37 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.67 -0.644 . . . . 1.77 109.963 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.13 -42.81 79.63 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.071 -1.018 . . . . 0.15 109.339 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.556 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.6 mt -60.52 -39.36 87.56 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.124 -1.065 . . . . 0.17 108.124 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.61 -34.37 73.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.466 -0.771 . . . . 1.07 109.892 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.68 -37.8 70.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.21 -0.931 . . . . 0.18 110.3 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -32.44 73.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.254 -0.904 . . . . 0.17 109.309 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.63 -124.76 21.95 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.983 -1.247 . . . . 0.2 109.983 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -91.41 4.74 51.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.397 -1.061 . . . . 1.07 110.271 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -76.54 149.3 36.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.154 -0.966 . . . . 1.5 109.096 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.644 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.86 156.68 16.76 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.503 -1.295 . . . . 0.47 107.503 179.631 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.644 ' H ' HD23 ' A' ' 22' ' ' LEU . 97.8 t -143.09 113.15 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.932 -1.105 . . . . 0.17 108.676 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.1 t -100.02 139.79 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.443 -0.947 . . . . 0.14 108.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.2 t -124.03 122.09 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.416 -0.803 . . . . 0.13 110.832 -178.827 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.528 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.7 t70 -98.44 120.24 38.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.631 -0.668 . . . . 1.05 110.305 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.53 25.74 4.89 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.96 -1.088 . . . . 0.73 109.756 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.535 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 57.0 m -59.43 143.25 50.35 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 120.878 -1.139 . . . . 0.3 110.453 -178.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.14 127.96 33.66 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 106.979 -1.489 . . . . 0.22 106.979 178.727 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -67.35 -32.25 73.06 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 118.894 -1.122 . . . . 0.3 108.318 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.623 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 61.3 p-90 -73.06 -19.8 61.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.023 -1.048 . . . . 0.26 110.657 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.2 t -85.24 116.73 23.76 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.736 -1.228 . . . . 0.26 107.867 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.451 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.57 -51.78 55.4 Favored Glycine 0 N--CA 1.496 2.662 0 O-C-N 121.659 -0.65 . . . . 0.23 111.978 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.1 Cg_exo -52.83 -36.09 72.56 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 CA-C-N 118.464 1.132 . . . . 0.31 111.907 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.535 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -76.52 -52.57 9.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.516 -0.74 . . . . 0.24 110.301 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -59.94 -36.59 77.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.129 -0.982 . . . . 1.59 109.332 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.506 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.9 tmm? -59.9 -29.3 68.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.501 -0.749 . . . . 2.1 109.549 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.604 HG22 ' O ' ' A' ' 38' ' ' ILE . 78.5 mt -79.44 -2.26 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.913 -0.492 . . . . 0.49 110.488 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.39 6.25 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 120.591 -1.318 . . . . 0.8 114.049 -177.891 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -57.24 -39.8 87.37 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 CA-C-N 121.842 1.693 . . . . 0.28 113.022 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -69.56 -48.52 60.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.262 -1.524 . . . . 0.37 108.651 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.06 -51.77 68.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.351 -0.843 . . . . 0.16 109.745 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -67.35 -40.94 85.87 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.589 -0.694 . . . . 0.32 110.385 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.449 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -61.31 -38.64 87.58 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.695 -1.253 . . . . 0.22 110.737 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.72 -21.52 66.44 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.22 110.701 -178.159 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -55.67 -35.62 66.2 Favored 'General case' 0 C--N 1.296 -1.721 0 O-C-N 120.894 -1.129 . . . . 0.16 108.277 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -85.97 -19.54 30.27 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.893 . . . . 2.16 109.897 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.24 -37.65 57.38 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 107.468 -1.308 . . . . 1.78 107.468 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.15 67.58 0.99 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.078 -1.453 . . . . 0.25 107.078 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.79 -8.27 10.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.037 -0.727 . . . . 0.22 109.037 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -90.67 10.2 26.73 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.115 -1.068 . . . . 1.13 108.115 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.5 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.5 t -129.56 142.08 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 107.696 -1.224 . . . . 0.24 107.696 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.457 HG22 ' CD1' ' A' ' 55' ' ' LEU . 26.8 mm -97.92 121.87 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.092 -1.005 . . . . 0.15 109.588 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.451 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.5 m-85 -101.62 124.15 46.8 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.364 -0.835 . . . . 0.12 109.159 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 2.3 mp -109.81 146.17 35.49 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.759 -1.213 . . . . 0.22 109.382 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.8 129.21 56.51 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 106.98 -1.489 . . . . 1.13 106.98 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.0 t -124.91 132.32 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.503 0.668 . . . . 0.15 110.377 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 54.6 t0 -95.68 118.7 32.84 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.531 -0.914 . . . . 1.05 108.531 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -65.59 -18.76 24.47 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 O-C-N 120.121 -1.612 . . . . 0.16 107.862 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.504 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.45 -40.85 10.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.631 . . . . 1.08 112.23 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.428 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 46.1 m-20 -95.61 -20.89 18.6 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.249 -1.532 . . . . 1.07 108.632 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.69 41.02 3.38 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.732 -1.21 . . . . 0.14 107.732 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -60.03 -20.66 59.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.579 -0.701 . . . . 1.47 110.097 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.721 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -62.77 -38.03 89.0 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 120.874 -1.141 . . . . 1.05 109.445 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.721 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.3 t -75.18 -44.46 43.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.013 -1.054 . . . . 0.35 109.825 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.34 -39.1 78.35 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.552 -0.859 . . . . 0.26 110.206 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -60.79 -36.48 79.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.007 -1.058 . . . . 0.24 108.539 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -63.09 -39.02 93.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 2.06 109.408 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.39 -0.06 55.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.23 110.697 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 53.09 50.2 18.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.966 -1.084 . . . . 2.02 109.728 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -66.55 132.38 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.859 -1.151 . . . . 0.16 109.35 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -103.19 -8.37 20.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.578 -0.701 . . . . 1.6 110.767 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.497 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.62 156.16 17.95 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.573 -1.33 . . . . 0.14 111.191 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.43 153.76 80.64 Favored Pre-proline 0 N--CA 1.502 2.148 0 N-CA-C 107.274 -1.38 . . . . 0.15 107.274 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -75.81 143.74 77.85 Favored 'Cis proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.848 -1.313 . . . . 0.16 112.788 -2.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.45 ' CG2' ' OE2' ' A' ' 88' ' ' GLU . 98.3 m -129.13 134.31 48.0 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.808 0.813 . . . . 0.13 108.953 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.77 ' CD1' HD21 ' A' ' 97' ' ' LEU . 93.4 m-85 -110.44 129.43 55.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 109.329 -0.619 . . . . 0.2 109.329 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -122.53 141.24 51.88 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.451 -0.944 . . . . 0.29 108.451 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -108.27 132.07 54.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.673 -0.642 . . . . 0.14 110.399 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -125.41 145.67 49.95 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.337 -0.616 . . . . 0.15 109.337 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -145.92 127.47 15.1 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.305 -1.368 . . . . 1.68 107.305 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 58.35 23.19 10.23 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.121 -1.066 . . . . 1.22 108.121 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 82.02 15.88 73.74 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 110.105 -1.198 . . . . 0.23 110.105 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.3 mm100 -116.2 138.01 51.64 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.519 -0.989 . . . . 2.07 109.891 -179.664 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -81.28 121.5 26.25 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.012 -1.107 . . . . 1.82 108.012 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.2 m -121.28 13.3 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.572 -0.705 . . . . 0.3 110.254 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -180.0 156.93 19.2 Favored Glycine 0 N--CA 1.496 2.637 0 C-N-CA 118.897 -1.621 . . . . 0.17 111.071 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.471 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 2.2 tp10 -166.84 147.73 5.91 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.65 -0.912 . . . . 1.93 108.727 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.456 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 11.0 p90 -166.98 162.58 15.69 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.199 -1.0 . . . . 0.14 108.945 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -128.88 169.61 14.4 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.621 0.724 . . . . 0.12 109.821 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.474 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 113.39 141.96 8.12 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.198 -1.561 . . . . 0.12 109.198 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.547 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -80.01 66.46 5.5 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.35 -1.088 . . . . 0.18 109.779 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -119.05 100.06 7.11 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.853 -1.166 . . . . 0.88 107.853 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.99 -33.37 73.57 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.352 -0.842 . . . . 1.06 111.924 -178.751 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -64.6 -29.49 70.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.802 -1.186 . . . . 1.61 110.051 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.413 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 55.2 tttp -61.9 -34.87 76.84 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.699 -0.852 . . . . 1.45 108.699 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.77 HD21 ' CD1' ' A' ' 77' ' ' PHE . 43.4 mt -59.48 -40.02 85.63 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 122.279 1.038 . . . . 0.19 108.484 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -62.61 -42.51 99.62 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.545 -0.752 . . . . 2.1 110.981 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.75 77.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.101 -0.999 . . . . 0.19 111.288 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -64.76 -39.59 93.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.773 -1.205 . . . . 0.2 110.129 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' VAL . 65.4 mt -61.55 -49.41 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.16 108.509 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.472 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.6 t-20 -60.26 -35.55 75.77 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.046 0.927 . . . . 0.95 108.613 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -67.32 -40.13 85.92 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.66 -0.65 . . . . 2.21 109.654 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.599 ' HB2' HD11 ' A' ' 22' ' ' LEU . 95.2 mt -98.74 -3.94 34.61 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.545 -0.722 . . . . 0.25 111.458 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.0 p . . . . . 0 N--CA 1.497 1.897 0 O-C-N 120.392 -1.443 . . . . 1.08 108.807 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo . . . . . 0 N--CA 1.493 1.496 0 CA-C-O 121.393 0.497 . . . . 1.46 112.35 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -92.17 125.15 36.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.253 -0.905 . . . . 0.88 109.366 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.463 HG22 ' H ' ' B' ' 63' ' ' LYS . 22.3 m -103.04 130.03 50.03 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.431 -0.793 . . . . 0.7 109.502 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.76 -27.45 67.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.417 -0.802 . . . . 0.61 109.703 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.463 ' H ' HG22 ' B' ' 61' ' ' THR . 29.8 mmtp -61.52 -18.28 58.45 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.243 -0.911 . . . . 1.31 109.711 -179.606 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.474 HD11 ' HA2' ' A' ' 91' ' ' GLY . 30.4 mm -128.8 140.42 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.914 -0.491 . . . . 0.15 110.304 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -95.66 129.76 42.76 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.224 -1.399 . . . . 0.19 107.224 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.6 m -78.52 140.58 38.54 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.757 -1.214 . . . . 0.2 111.049 -178.886 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.497 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.0 m95 -76.12 -8.44 57.01 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.699 -1.25 . . . . 0.21 108.975 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 32.1 m-20 -53.79 -11.95 0.47 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.124 -0.985 . . . . 0.49 108.739 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.442 ' N ' ' C ' ' B' ' 67' ' ' TRP . 16.8 m -61.85 143.57 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 1.04 109.602 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.27 -38.18 85.81 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.238 -0.914 . . . . 1.36 108.932 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.387 -1.485 . . . . 2.32 109.387 -179.879 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.5 mmm . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.34 0.591 . . . . 2.88 109.758 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.3 t -99.47 132.17 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.508 -0.745 . . . . 0.45 109.234 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -132.29 133.54 44.19 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.208 -0.933 . . . . 1.67 108.848 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -97.79 124.11 42.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.383 -0.823 . . . . 0.31 109.288 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.28 115.85 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.349 -0.845 . . . . 0.19 108.788 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -99.67 -0.89 39.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.265 -0.897 . . . . 2.25 108.978 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -151.68 153.88 35.25 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.046 . . . . 0.15 111.04 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -64.3 -31.55 72.8 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.254 -1.017 . . . . 1.65 108.254 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.5 m -58.15 -47.21 84.07 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.382 -0.927 . . . . 0.23 108.601 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.12 -30.9 70.15 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.515 -0.74 . . . . 0.17 109.107 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.49 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.8 t80 -59.35 -44.05 92.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.252 -0.905 . . . . 0.14 108.977 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -65.41 -41.85 93.17 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.404 -0.961 . . . . 1.31 108.404 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.37 -37.49 87.7 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.664 -0.648 . . . . 1.77 110.299 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.12 79.14 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.277 -0.89 . . . . 0.15 109.586 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.49 HD11 ' CE2' ' A' ' 11' ' ' PHE . 88.3 mt -60.15 -40.63 90.52 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.166 -0.959 . . . . 0.17 108.537 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -68.48 -37.08 79.82 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.654 -0.653 . . . . 1.07 110.243 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.06 -36.65 80.21 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.44 -0.787 . . . . 0.18 110.406 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.31 -33.11 74.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.041 -1.037 . . . . 0.17 109.294 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.19 20.18 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.268 -1.133 . . . . 0.2 110.268 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.462 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 71.0 m-20 -89.92 0.53 57.02 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.263 -1.139 . . . . 1.07 110.457 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -73.98 147.59 42.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.825 -1.172 . . . . 1.5 109.401 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.692 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.21 159.73 7.25 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.118 -1.438 . . . . 0.47 107.118 179.79 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.685 ' H ' HD23 ' A' ' 22' ' ' LEU . 96.0 t -146.41 121.27 2.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 O-C-N 120.812 -1.18 . . . . 0.17 108.605 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.4 HG22 ' CE2' ' A' ' 79' ' ' PHE . 23.6 t -109.59 140.0 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.305 -0.998 . . . . 0.14 108.305 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.59 121.27 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.329 -0.857 . . . . 0.13 109.557 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.2 t70 -98.41 117.61 33.21 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.457 -0.777 . . . . 1.05 109.756 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -94.48 25.72 3.78 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.142 -0.974 . . . . 0.73 110.02 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.414 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 53.2 m -59.31 146.62 38.92 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 121.102 -0.999 . . . . 0.3 110.616 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.531 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.42 126.82 32.64 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.785 -1.191 . . . . 0.22 107.785 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.13 -31.61 71.31 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.938 -1.105 . . . . 0.3 108.909 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.531 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 56.1 p-90 -74.1 -22.4 59.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.427 -0.795 . . . . 0.26 111.04 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -83.39 110.44 18.15 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.74 -1.207 . . . . 0.26 107.74 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.474 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.86 -50.35 68.49 Favored Glycine 0 N--CA 1.485 1.907 0 C-N-CA 120.258 -0.972 . . . . 0.23 110.772 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.5 Cg_exo -52.48 -34.86 63.79 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 CA-C-N 118.88 1.34 . . . . 0.31 111.804 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.01 -50.73 11.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.24 110.247 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -60.19 -35.27 75.02 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.05 -1.031 . . . . 1.59 109.37 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.3 ttt -58.68 -27.32 64.71 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.391 -0.818 . . . . 2.1 109.571 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.571 HG22 ' O ' ' A' ' 38' ' ' ILE . 70.0 mt -85.02 -3.77 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.694 -0.629 . . . . 0.49 110.882 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.547 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.5 ptmt -66.94 -27.05 1.6 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 120.278 -1.514 . . . . 0.8 113.315 -177.929 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.9 Cg_exo -56.38 -39.33 91.98 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 CA-C-N 122.349 1.875 . . . . 0.28 112.117 -177.592 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -68.17 -46.06 71.77 Favored 'General case' 0 C--N 1.301 -1.506 0 C-N-CA 118.181 -1.408 . . . . 0.37 108.458 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -60.11 -52.1 66.79 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.914 0.864 . . . . 0.16 109.406 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -67.27 -45.57 76.24 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.7 -0.625 . . . . 0.32 110.244 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.3 m -60.2 -38.4 83.2 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.263 -0.898 . . . . 0.22 110.601 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 mt -63.08 -24.48 67.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.086 -1.009 . . . . 0.22 110.753 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.4 m -53.4 -36.24 61.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.872 -1.142 . . . . 0.16 108.745 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 mp0 -85.3 -15.98 41.57 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.035 -1.041 . . . . 2.16 108.627 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.0 -37.61 38.77 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.393 -1.336 . . . . 1.78 107.393 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -123.69 69.05 1.03 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.338 -1.356 . . . . 0.25 107.338 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -65.66 -13.45 59.21 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 108.35 -0.981 . . . . 0.22 108.35 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -82.23 -3.74 55.69 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.321 -0.992 . . . . 1.13 108.321 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.476 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.0 t -118.43 141.75 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 N-CA-C 107.463 -1.31 . . . . 0.24 107.463 178.752 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -97.96 122.38 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.172 -0.955 . . . . 0.15 109.822 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.657 ' C ' HD12 ' A' ' 55' ' ' LEU . 39.1 m-85 -101.06 131.51 46.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.311 -0.868 . . . . 0.12 110.419 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.657 HD12 ' C ' ' A' ' 54' ' ' PHE . 6.4 mp -116.33 140.96 48.78 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.288 -0.883 . . . . 0.22 109.243 178.49 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -110.21 130.01 55.62 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.843 -1.54 . . . . 1.13 106.843 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.99 135.11 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.253 -0.904 . . . . 0.15 110.663 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.507 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 54.3 t0 -97.03 119.76 36.12 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.76 -0.83 . . . . 1.05 108.76 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 28.1 m -68.85 -17.63 22.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.786 -1.197 . . . . 0.16 108.213 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.529 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.5 m-20 -94.24 -41.02 9.69 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.403 -0.81 . . . . 1.08 112.041 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.451 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 41.0 m-20 -96.86 -16.56 20.69 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.598 -1.314 . . . . 1.07 108.293 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.09 39.89 3.86 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.03 -1.1 . . . . 0.14 108.03 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -60.08 -24.56 64.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.676 -0.64 . . . . 1.47 110.224 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.545 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.4 p30 -63.71 -37.33 86.94 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.812 -1.18 . . . . 1.05 108.739 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.545 HG23 ' OD1' ' A' ' 64' ' ' ASP . 8.1 t -70.34 -44.04 77.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.271 -0.893 . . . . 0.35 109.587 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.52 67.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.516 -0.74 . . . . 0.26 111.178 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -60.26 -35.72 76.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.948 -1.095 . . . . 0.24 109.541 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -63.65 -36.9 85.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.292 -0.88 . . . . 2.06 109.181 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.417 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -88.44 -2.21 58.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.23 -0.919 . . . . 0.23 110.884 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 55.44 49.04 17.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.04 -1.038 . . . . 2.02 109.847 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.4 t -64.05 133.02 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 C-N-CA 118.574 -1.25 . . . . 0.16 108.442 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -104.86 -12.36 16.29 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.639 -0.663 . . . . 1.6 109.936 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.55 155.99 20.34 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.849 -1.157 . . . . 0.14 111.207 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.405 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.5 p -129.31 155.51 79.89 Favored Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 107.859 -1.163 . . . . 0.15 107.859 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -76.05 141.77 71.56 Favored 'Cis proline' 0 N--CA 1.493 1.469 0 C-N-CA 123.749 -1.355 . . . . 0.16 112.675 -1.957 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -127.38 137.3 52.72 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.597 -0.89 . . . . 0.13 108.597 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.789 ' CD1' HD21 ' A' ' 97' ' ' LEU . 90.9 m-85 -113.74 130.04 56.49 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 108.612 -0.884 . . . . 0.2 108.612 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.454 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 80.9 mt-30 -120.57 140.02 52.11 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.269 -0.894 . . . . 0.29 108.673 179.341 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.436 ' CE1' HG21 ' A' ' 100' ' ' THR . 86.5 m-85 -107.48 133.01 52.6 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.436 0.636 . . . . 0.14 110.318 -179.168 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -128.61 145.92 51.0 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 108.996 -0.742 . . . . 0.15 108.996 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -147.81 131.24 16.66 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.16 -1.422 . . . . 1.68 107.16 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.462 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 68.6 mttm 56.01 27.93 12.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.279 -0.888 . . . . 1.22 109.549 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.86 15.29 79.5 Favored Glycine 0 N--CA 1.493 2.485 0 C-N-CA 120.061 -1.066 . . . . 0.23 110.902 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 93.6 mt-30 -125.06 141.54 52.06 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.088 -1.243 . . . . 2.07 110.508 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.454 ' NZ ' ' OE1' ' A' ' 78' ' ' GLN . 20.3 ttmm -78.56 126.98 31.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.274 -0.892 . . . . 1.82 109.392 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.89 11.75 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.728 -0.608 . . . . 0.3 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.93 154.14 14.52 Favored Glycine 0 N--CA 1.494 2.552 0 C-N-CA 118.388 -1.863 . . . . 0.17 111.743 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 3.2 tp10 -165.14 136.49 4.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.997 -0.708 . . . . 1.93 109.642 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.543 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.9 p90 -163.26 158.5 21.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.328 -0.857 . . . . 0.14 109.947 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -127.97 160.18 32.7 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.61 0.719 . . . . 0.12 110.37 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 126.56 141.88 5.55 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.394 -1.482 . . . . 0.12 109.394 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.451 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.2 65.17 2.12 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.339 -1.095 . . . . 0.18 109.626 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 52.0 t-20 -120.0 97.78 5.77 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.353 -0.842 . . . . 0.88 108.77 179.042 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -33.28 73.31 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.017 -1.052 . . . . 1.06 111.174 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.18 -30.08 70.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.953 -1.092 . . . . 1.61 109.68 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.54 -34.72 74.55 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.566 -0.709 . . . . 1.45 109.337 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.789 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.4 mt -59.44 -40.07 85.59 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.551 -0.907 . . . . 0.19 108.551 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.95 -43.92 97.48 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 119.402 -0.919 . . . . 2.1 110.347 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.62 -44.81 77.1 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.136 -1.026 . . . . 0.19 110.624 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.436 HG21 ' CE1' ' A' ' 79' ' ' PHE . 22.0 m -64.3 -40.06 95.18 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.793 -1.192 . . . . 0.2 108.478 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.95 -46.64 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 107.503 -1.295 . . . . 0.16 107.503 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.473 ' O ' HG12 ' A' ' 105' ' ' VAL . 49.4 t30 -60.12 -35.94 76.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.05 -1.093 . . . . 0.95 108.05 179.216 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -68.73 -40.1 80.05 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.626 -0.671 . . . . 2.21 110.164 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.692 ' HB2' HD11 ' A' ' 22' ' ' LEU . 87.6 mt -98.26 -2.73 38.9 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.143 -0.973 . . . . 0.25 111.63 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.2 p . . . . . 0 N--CA 1.499 1.999 0 O-C-N 120.504 -1.372 . . . . 1.08 109.551 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.494 1.55 0 CA-C-O 121.001 0.334 . . . . 1.46 112.13 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.93 122.72 45.77 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.263 -0.898 . . . . 0.88 108.833 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.426 HG22 ' H ' ' B' ' 63' ' ' LYS . 30.7 m -108.92 129.95 55.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.477 -0.764 . . . . 0.7 110.002 -179.282 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -66.61 -30.73 71.07 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.373 -0.83 . . . . 0.61 109.614 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.426 ' H ' HG22 ' B' ' 61' ' ' THR . 70.2 mmtt -59.15 -21.65 59.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.469 -0.769 . . . . 1.31 109.706 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.445 HD11 ' HA2' ' A' ' 91' ' ' GLY . 36.3 mm -130.04 141.44 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.812 -0.555 . . . . 0.15 109.754 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 24.2 m -99.9 131.51 45.83 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 106.934 -1.506 . . . . 0.19 106.934 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -84.06 142.69 30.24 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.661 -1.275 . . . . 0.2 111.441 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.448 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.4 m95 -75.44 -11.14 59.98 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.216 -0.927 . . . . 0.21 108.995 178.745 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 24.6 m-20 -51.86 -13.05 0.24 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.513 -0.921 . . . . 0.49 108.513 179.825 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.481 HG11 ' CH2' ' A' ' 31' ' ' TRP . 16.0 m -60.74 140.58 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 1.04 109.362 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.24 -38.97 85.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.068 -1.02 . . . . 1.36 109.297 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 118.202 -1.332 . . . . 2.32 110.027 -179.079 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.2 ttm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.238 -0.653 . . . . 2.88 109.238 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 43' ' ' HIS . 94.3 t -98.24 152.73 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.177 -0.952 . . . . 0.45 109.958 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -130.14 126.0 36.43 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.707 -0.849 . . . . 1.67 108.707 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -98.18 124.07 42.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.633 -0.877 . . . . 0.31 108.633 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.0 mm -101.16 112.66 34.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.956 -0.757 . . . . 0.19 108.956 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.468 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.0 mp0 -95.53 -0.2 52.36 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.195 -0.94 . . . . 2.25 109.464 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -156.04 159.33 39.04 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.909 -1.119 . . . . 0.15 111.166 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -65.41 -31.92 73.27 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.174 -1.047 . . . . 1.65 108.174 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.8 m -58.01 -49.46 76.76 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.517 -0.873 . . . . 0.23 109.067 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.26 69.24 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.323 -0.86 . . . . 0.17 109.042 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.54 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.7 t80 -58.48 -43.58 89.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.037 -1.039 . . . . 0.14 108.713 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -64.56 -43.87 92.54 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.966 -0.753 . . . . 1.31 108.966 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.59 -36.26 83.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.645 -0.66 . . . . 1.77 110.059 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.32 80.89 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.165 -0.959 . . . . 0.15 109.19 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.54 HD11 ' CE2' ' A' ' 11' ' ' PHE . 75.7 mt -61.14 -41.18 96.27 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.186 -0.946 . . . . 0.17 109.016 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -68.46 -35.26 77.32 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.628 -0.67 . . . . 1.07 110.508 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -39.58 81.18 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.271 -0.893 . . . . 0.18 110.234 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' A' ' 23' ' ' VAL . . . -60.85 -34.6 74.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.386 -0.821 . . . . 0.17 109.746 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -124.58 21.2 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.648 -1.381 . . . . 0.2 109.648 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -90.75 -1.53 57.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 120.982 -1.304 . . . . 1.07 110.51 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -75.02 149.99 39.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.934 -1.104 . . . . 1.5 108.805 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 22' ' ' LEU . 10.8 mt -58.79 160.03 6.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.09 -1.006 . . . . 0.47 110.543 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.4 ' CG2' ' CB ' ' A' ' 18' ' ' ALA . 62.9 t -148.0 111.75 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 107.974 -1.121 . . . . 0.17 107.974 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.409 HG22 ' CD2' ' A' ' 79' ' ' PHE . 59.8 t -103.66 144.19 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 107.47 -1.308 . . . . 0.14 107.47 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.9 t -125.34 122.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.192 -0.942 . . . . 0.13 110.549 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.53 117.41 33.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.377 -0.827 . . . . 1.05 109.932 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -94.12 26.45 3.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.937 . . . . 0.73 110.179 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -60.3 144.65 50.01 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.823 -1.173 . . . . 0.3 110.16 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.553 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.57 125.5 32.49 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.43 -0.952 . . . . 0.22 108.43 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.0 t -65.59 -32.71 74.44 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.105 -0.997 . . . . 0.3 108.729 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.553 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 54.7 p-90 -72.11 -23.22 61.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.196 -0.94 . . . . 0.26 111.03 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 21.5 t -81.05 123.19 28.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.768 -1.207 . . . . 0.26 108.734 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.94 -56.53 22.0 Favored Glycine 0 N--CA 1.493 2.446 0 O-C-N 121.637 -0.664 . . . . 0.23 112.159 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 8.0 Cg_endo -59.94 -29.48 89.5 Favored 'Trans proline' 0 C--N 1.314 -1.267 0 CA-C-N 119.45 1.625 . . . . 0.31 112.605 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.414 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -77.22 -54.99 5.81 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.844 -1.16 . . . . 0.24 109.918 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt -60.26 -39.32 86.36 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.085 -1.009 . . . . 1.59 109.444 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.512 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.3 tmt? -59.76 -28.92 67.8 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.653 -0.654 . . . . 2.1 109.89 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 38' ' ' ILE . 68.0 mt -80.73 -3.7 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.708 -0.62 . . . . 0.49 110.454 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.4 ptmt -65.12 -27.6 2.3 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 120.486 -1.384 . . . . 0.8 113.295 -177.598 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.0 Cg_exo -55.93 -39.27 92.19 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 CA-C-N 122.563 1.951 . . . . 0.28 112.888 -176.227 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.12 -45.01 71.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.632 -1.292 . . . . 0.37 108.842 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.38 -52.81 63.08 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.121 -0.987 . . . . 0.16 109.454 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.462 ' CE1' HG21 ' A' ' 2' ' ' VAL . 48.0 t60 -68.22 -40.29 82.12 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.774 -0.578 . . . . 0.32 110.678 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.8 m -62.61 -39.62 94.34 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.22 111.374 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -63.92 -19.43 65.1 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.912 -1.117 . . . . 0.22 110.372 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.4 m -55.16 -38.43 68.29 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 120.755 -1.216 . . . . 0.16 108.481 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -83.2 -17.59 42.24 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.031 -1.043 . . . . 2.16 109.635 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -77.93 -35.9 49.96 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.453 -1.314 . . . . 1.78 107.453 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -122.46 68.15 0.95 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.077 -1.453 . . . . 0.25 107.077 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.8 p -66.1 -9.61 32.78 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.642 -0.873 . . . . 0.22 108.642 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -88.91 6.66 38.29 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.056 -1.09 . . . . 1.13 108.056 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 78.7 t -127.05 146.41 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 107.885 -1.154 . . . . 0.24 107.885 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.409 HG22 ' CD1' ' A' ' 55' ' ' LEU . 22.8 mm -99.98 123.84 53.05 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 120.822 -1.174 . . . . 0.15 109.777 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.487 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.2 m-85 -105.72 125.59 51.16 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.273 -0.892 . . . . 0.12 109.179 179.12 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.487 HD12 ' C ' ' A' ' 54' ' ' PHE . 3.2 mp -110.33 141.18 43.71 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.984 -1.073 . . . . 0.22 109.566 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -110.89 131.67 54.85 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 106.517 -1.66 . . . . 1.13 106.517 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.3 t -126.49 137.52 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.404 -0.81 . . . . 0.15 110.097 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.55 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.1 t0 -99.06 119.22 37.46 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 107.821 -1.178 . . . . 1.05 107.821 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -67.99 -18.72 23.94 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 120.66 -1.275 . . . . 0.16 108.469 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.551 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -92.63 -41.19 10.33 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.548 -0.72 . . . . 1.08 111.819 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -96.48 -18.71 19.66 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.596 -1.315 . . . . 1.07 108.062 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -120.44 38.87 3.88 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.569 -1.271 . . . . 0.14 107.569 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -60.34 -23.51 64.31 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.702 -0.624 . . . . 1.47 109.947 -178.541 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.605 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -64.82 -38.13 89.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.696 -1.253 . . . . 1.05 109.216 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.605 HG23 ' OD1' ' A' ' 64' ' ' ASP . 14.2 t -70.89 -44.16 76.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 121.786 0.803 . . . . 0.35 109.618 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.99 -39.71 72.3 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.685 -0.634 . . . . 0.26 110.5 -178.45 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.4 p -59.97 -32.54 70.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.936 -1.102 . . . . 0.24 109.02 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -62.26 -39.04 91.59 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.438 -0.789 . . . . 2.06 108.901 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.22 0.2 57.31 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.559 -0.713 . . . . 0.23 110.923 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 53.29 49.97 18.63 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.996 -1.065 . . . . 2.02 109.684 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.18 133.13 30.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.735 -1.228 . . . . 0.16 108.684 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.2 -10.89 18.42 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.588 -0.695 . . . . 1.6 110.41 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.469 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.18 157.08 20.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.595 -1.316 . . . . 0.14 111.007 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -128.53 155.08 79.38 Favored Pre-proline 0 N--CA 1.501 2.115 0 N-CA-C 107.516 -1.29 . . . . 0.15 107.516 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -75.62 140.83 68.74 Favored 'Cis proline' 0 N--CA 1.493 1.461 0 C-N-CA 123.731 -1.362 . . . . 0.16 113.206 -3.488 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -126.03 137.32 53.64 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.057 -1.09 . . . . 0.13 108.057 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.434 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 90.2 m-85 -115.9 131.1 57.04 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.863 -1.162 . . . . 0.2 107.863 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -123.93 144.65 49.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.281 -0.887 . . . . 0.29 108.916 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.409 ' CD2' HG22 ' A' ' 24' ' ' VAL . 55.6 m-85 -108.23 132.51 53.58 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.639 0.733 . . . . 0.14 110.693 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -126.86 143.37 51.29 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.662 -0.866 . . . . 0.15 108.662 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -146.72 128.37 15.18 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.536 -1.283 . . . . 1.68 107.536 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.2 mttp 59.22 28.22 17.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.467 -0.938 . . . . 1.22 108.467 -178.79 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.11 18.96 79.06 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.742 -1.343 . . . . 0.23 109.742 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 39.1 mm-40 -123.71 139.9 53.52 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.389 -1.065 . . . . 2.07 110.957 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -80.03 123.32 27.73 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.846 -0.798 . . . . 1.82 108.846 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.4 m -123.15 9.37 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.513 -0.742 . . . . 0.3 111.122 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.0 160.26 27.24 Favored Glycine 0 N--CA 1.498 2.768 0 C-N-CA 118.795 -1.669 . . . . 0.17 110.948 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.499 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.5 tp10 -169.01 148.0 4.0 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.627 -0.925 . . . . 1.93 109.612 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.499 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 5.6 p90 -168.63 157.39 8.56 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.471 -0.768 . . . . 0.14 109.911 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -128.47 160.09 33.38 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.611 -0.681 . . . . 0.12 109.5 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.511 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.39 143.49 6.33 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.312 -1.515 . . . . 0.12 109.312 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.12 67.64 3.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.05 -1.265 . . . . 0.18 110.207 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.6 t-20 -120.82 95.31 4.66 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.478 -0.764 . . . . 0.88 108.985 178.854 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -32.21 70.97 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.143 -0.973 . . . . 1.06 111.679 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.89 -29.7 70.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.851 -1.155 . . . . 1.61 109.572 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -60.34 -35.45 75.68 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.46 0.647 . . . . 1.45 109.327 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.0 mt -59.26 -39.85 84.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 122.083 0.945 . . . . 0.19 108.709 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -62.35 -43.68 98.25 Favored 'General case' 0 C--N 1.288 -2.093 0 C-N-CA 120.104 -0.638 . . . . 2.1 110.98 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.29 -43.15 74.42 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.073 -1.017 . . . . 0.19 111.135 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.0 m -64.96 -39.91 94.19 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.825 -1.172 . . . . 0.2 110.147 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.28 -49.25 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.16 108.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.406 ' O ' HG12 ' A' ' 105' ' ' VAL . 25.9 t-20 -60.56 -34.87 74.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.124 0.964 . . . . 0.95 108.653 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.8 tm-20 -67.86 -40.02 83.67 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.427 -0.796 . . . . 2.21 110.037 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.6 mt -100.2 -4.61 29.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.216 -0.928 . . . . 0.25 111.732 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.424 ' OXT' HG13 ' A' ' 105' ' ' VAL . 9.9 p . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.198 -1.564 . . . . 1.08 109.048 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo . . . . . 0 N--CA 1.495 1.575 0 CA-C-O 121.113 0.38 . . . . 1.46 112.508 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.03 125.81 39.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 0.88 109.157 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.458 ' O ' ' O ' ' B' ' 64' ' ' ILE . 26.7 m -109.39 129.94 55.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.782 -0.821 . . . . 0.7 108.782 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 80.9 mt -67.97 -30.38 69.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.926 -1.109 . . . . 0.61 108.901 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.434 ' H ' HG22 ' B' ' 61' ' ' THR . 69.3 mmtt -59.88 -21.15 60.63 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.847 -0.797 . . . . 1.31 108.847 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.511 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.5 mm -131.6 144.8 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.628 0 O-C-N 121.894 -0.504 . . . . 0.15 109.822 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.88 132.08 50.48 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 107.522 -1.288 . . . . 0.19 107.522 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -82.56 140.74 33.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.807 -1.183 . . . . 0.2 111.054 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.469 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.7 m95 -76.97 -7.94 56.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.896 -1.128 . . . . 0.21 108.458 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 47.4 m-20 -54.54 -11.79 0.61 Allowed 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.374 -0.972 . . . . 0.49 108.374 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.476 HG11 ' CH2' ' A' ' 31' ' ' TRP . 18.9 m -60.5 140.12 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.379 -0.826 . . . . 1.04 108.869 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -60.14 -40.4 89.68 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.41 -0.806 . . . . 1.36 110.149 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.44 -1.464 . . . . 2.32 109.44 -179.317 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.4 0.619 . . . . 2.88 109.783 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.6 t -99.12 155.26 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.437 -0.789 . . . . 0.45 109.599 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -130.09 130.01 44.31 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 108.464 -0.939 . . . . 1.67 108.464 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -98.89 122.25 41.89 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.295 -0.878 . . . . 0.31 108.878 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.7 mm -100.06 114.65 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 N-CA-C 108.673 -0.862 . . . . 0.19 108.673 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -99.77 -0.08 40.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.258 -0.902 . . . . 2.25 109.547 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -154.29 156.83 37.7 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.966 -1.084 . . . . 0.15 110.982 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -64.24 -32.21 73.71 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.974 -1.121 . . . . 1.65 107.974 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -56.49 -47.49 79.14 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.539 -0.912 . . . . 0.23 108.539 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.71 -31.6 69.7 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.439 -0.788 . . . . 0.17 109.243 178.8 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.505 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.9 t80 -58.7 -44.66 90.41 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.005 -1.059 . . . . 0.14 109.033 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -64.52 -42.2 95.93 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 108.832 -0.803 . . . . 1.31 108.832 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.58 -36.26 83.66 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.383 0.611 . . . . 1.77 110.399 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.82 77.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.301 -0.874 . . . . 0.15 108.999 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.505 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.5 mt -60.12 -40.05 88.39 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.96 -1.126 . . . . 0.17 107.96 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -69.81 -40.14 76.1 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.55 -0.719 . . . . 1.07 110.264 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.14 -32.37 68.87 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.37 -0.831 . . . . 0.18 110.457 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.59 -26.19 68.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.048 -1.033 . . . . 0.17 108.997 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.17 -130.91 30.04 Favored Glycine 0 N--CA 1.487 2.04 0 N-CA-C 109.8 -1.32 . . . . 0.2 109.8 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.62 3.0 56.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.233 -1.157 . . . . 1.07 110.729 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -73.44 149.49 42.38 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.886 -1.134 . . . . 1.5 109.665 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.645 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -58.52 158.72 7.25 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.056 -1.461 . . . . 0.47 107.056 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.645 ' H ' HD23 ' A' ' 22' ' ' LEU . 85.3 t -143.91 109.69 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 120.93 -1.106 . . . . 0.17 108.816 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.2 t -98.64 141.27 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 108.222 -1.029 . . . . 0.14 108.222 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.9 t -124.17 122.41 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.503 -0.748 . . . . 0.13 109.518 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -99.3 116.45 31.5 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.275 -0.891 . . . . 1.05 109.633 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -92.41 20.43 6.18 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.061 -1.024 . . . . 0.73 109.875 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.29 146.09 20.13 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.735 -1.228 . . . . 0.3 110.483 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.729 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.6 122.4 30.48 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.927 -1.138 . . . . 0.22 107.927 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -63.81 -29.86 71.02 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.062 -1.055 . . . . 0.3 108.582 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.729 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 63.6 p-90 -74.88 -17.88 60.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.312 -0.867 . . . . 0.26 110.694 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -84.76 119.53 25.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.792 -1.193 . . . . 0.26 108.55 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.481 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.97 -54.14 39.33 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.894 -0.67 . . . . 0.23 112.247 -178.236 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.9 Cg_endo -60.18 -29.95 90.21 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 CA-C-N 119.286 1.543 . . . . 0.31 112.426 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.49 -48.01 20.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.051 . . . . 0.24 109.753 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -59.97 -32.48 70.86 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.18 -0.95 . . . . 1.59 109.09 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 15.1 tmm? -59.09 -26.95 65.09 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.34 -0.85 . . . . 2.1 110.041 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.443 HD11 ' HB1' ' A' ' 92' ' ' ALA . 6.0 mt -82.21 -5.72 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.398 -0.814 . . . . 0.49 111.223 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.02 -30.36 7.18 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 119.802 -1.811 . . . . 0.8 113.336 -178.203 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.3 Cg_exo -60.0 -42.46 44.1 Favored 'Trans proline' 0 C--O 1.204 -1.189 0 CA-C-N 121.518 1.578 . . . . 0.28 112.027 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.22 -48.81 60.93 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 118.525 -1.27 . . . . 0.37 109.362 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.16 -52.82 63.7 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.806 0.812 . . . . 0.16 109.775 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -67.87 -40.32 83.61 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.797 -0.564 . . . . 0.32 111.033 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.6 m -64.2 -38.2 90.19 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.77 -1.206 . . . . 0.22 110.777 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.14 -20.5 65.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.141 -0.974 . . . . 0.22 111.142 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -52.95 -40.53 63.74 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 120.824 -1.173 . . . . 0.16 109.075 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -84.92 -16.64 40.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.115 -0.991 . . . . 2.16 109.432 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -76.21 -37.95 57.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.24 -1.393 . . . . 1.78 107.24 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.43 ' C ' ' H ' ' A' ' 51' ' ' ASN . 84.3 m-85 -123.63 68.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.282 -1.377 . . . . 0.25 107.282 177.765 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.3 p -62.81 -5.12 2.52 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.104 -1.073 . . . . 0.22 108.104 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.9 t-20 -80.48 -20.2 44.23 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.921 -0.77 . . . . 1.13 108.921 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 22' ' ' LEU . 62.4 t -109.55 147.61 13.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 N-CA-C 108.465 -0.939 . . . . 0.24 108.465 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -99.77 118.36 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 108.695 -0.854 . . . . 0.15 108.695 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.562 ' C ' HD12 ' A' ' 55' ' ' LEU . 21.1 m-85 -97.43 124.99 41.81 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.021 -1.05 . . . . 0.12 109.798 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.562 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.5 mp -110.07 141.75 42.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.264 -0.898 . . . . 0.22 108.969 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -109.79 130.17 55.55 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.881 -1.526 . . . . 1.13 106.881 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.7 t -125.76 135.48 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.384 -0.822 . . . . 0.15 110.414 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.483 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.4 t0 -97.38 118.87 34.83 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.474 -0.766 . . . . 1.05 109.145 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.9 m -66.12 -20.46 27.3 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 120.584 -1.322 . . . . 0.16 108.392 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.521 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 19.0 m-20 -91.41 -44.05 9.37 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.551 -0.718 . . . . 1.08 112.077 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.434 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 70.4 m-20 -95.21 -14.46 24.05 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.582 -1.324 . . . . 1.07 108.892 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.92 37.82 4.32 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.349 -1.352 . . . . 0.14 107.349 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -59.93 -21.17 60.79 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 121.128 0.49 . . . . 1.47 110.116 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.593 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -65.5 -39.15 91.54 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.906 -1.121 . . . . 1.05 108.482 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.593 HG23 ' OD1' ' A' ' 64' ' ' ASP . 15.4 t -70.95 -45.67 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.434 -0.791 . . . . 0.35 109.527 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -37.42 75.84 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.545 -0.722 . . . . 0.26 110.884 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.2 p -60.56 -38.0 83.11 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.978 -1.077 . . . . 0.24 109.845 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.1 -38.89 92.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.192 -0.942 . . . . 2.06 109.88 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -83.46 -2.97 57.11 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 0.23 109.909 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 55.08 49.84 16.63 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.357 -0.84 . . . . 2.02 109.479 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.39 130.16 27.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.708 -1.197 . . . . 0.16 108.568 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -102.28 -10.98 19.06 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.701 -0.624 . . . . 1.6 110.57 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.482 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.87 155.77 16.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.687 -1.258 . . . . 0.14 110.962 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -129.67 155.32 80.52 Favored Pre-proline 0 N--CA 1.504 2.238 0 N-CA-C 108.563 -0.902 . . . . 0.15 108.563 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -75.38 142.16 73.5 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.882 -1.299 . . . . 0.16 113.073 -2.394 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.482 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 87.2 m -127.3 136.23 51.65 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 108.553 -0.906 . . . . 0.13 108.553 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.626 ' CD1' HD21 ' A' ' 97' ' ' LEU . 92.7 m-85 -114.09 130.14 56.59 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 108.674 -0.861 . . . . 0.2 108.674 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -121.97 140.85 51.95 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.704 -0.85 . . . . 0.29 108.704 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -107.75 132.16 53.68 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.544 0.688 . . . . 0.14 110.887 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -127.21 149.37 50.02 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.472 0.653 . . . . 0.15 109.476 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -149.55 125.13 10.35 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.623 -1.251 . . . . 1.68 107.623 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.2 mttt 58.82 28.41 17.39 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.811 -1.181 . . . . 1.22 107.811 -178.728 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.55 13.51 83.43 Favored Glycine 0 N--CA 1.487 2.073 0 N-CA-C 110.049 -1.22 . . . . 0.23 110.049 -179.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.5 mm100 -114.78 134.69 54.91 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.269 -1.136 . . . . 2.07 110.409 -179.569 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -81.32 121.91 26.79 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.55 -0.907 . . . . 1.82 108.55 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.2 m -125.16 16.33 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.628 -0.67 . . . . 0.3 110.607 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.43 155.47 15.15 Favored Glycine 0 N--CA 1.495 2.624 0 C-N-CA 118.924 -1.607 . . . . 0.17 110.994 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.484 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.3 tp10 -168.0 149.32 5.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.619 -0.882 . . . . 1.93 108.619 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.484 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.0 p90 -168.5 158.86 9.85 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.134 -0.979 . . . . 0.14 109.434 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -127.19 162.33 26.41 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.388 -0.82 . . . . 0.12 110.335 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.487 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.44 142.77 6.46 Favored Glycine 0 N--CA 1.503 3.119 0 N-CA-C 109.985 -1.246 . . . . 0.12 109.985 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.443 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -77.27 64.53 2.69 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.028 -1.278 . . . . 0.18 110.208 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -118.61 97.82 5.93 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.264 -1.013 . . . . 0.88 108.264 178.647 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -32.63 71.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.185 -0.947 . . . . 1.06 111.461 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.46 -30.82 71.88 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.975 -1.078 . . . . 1.61 109.371 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.94 -34.7 75.13 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.323 0.582 . . . . 1.45 109.58 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.626 HD21 ' CD1' ' A' ' 77' ' ' PHE . 58.9 mt -59.53 -37.81 79.34 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.039 0.923 . . . . 0.19 108.574 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -64.09 -42.04 97.07 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 120.3 -0.56 . . . . 2.1 111.425 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -43.94 77.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.961 -1.087 . . . . 0.19 111.565 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -65.75 -38.91 90.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.834 -1.166 . . . . 0.2 109.72 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.93 -49.97 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.041 -1.037 . . . . 0.16 108.405 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.454 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.3 t-20 -60.14 -34.9 74.18 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-O 122.091 0.948 . . . . 0.95 108.458 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -67.91 -39.88 83.51 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.574 -0.703 . . . . 2.21 109.938 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.618 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.8 mt -99.52 -1.69 37.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.202 -0.936 . . . . 0.25 111.414 -179.168 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.475 HG13 ' O ' ' A' ' 105' ' ' VAL . 9.2 p . . . . . 0 N--CA 1.496 1.872 0 O-C-N 120.297 -1.502 . . . . 1.08 109.1 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo . . . . . 0 N--CA 1.496 1.631 0 CA-C-O 120.902 0.293 . . . . 1.46 112.311 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -99.14 115.79 29.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.162 -0.961 . . . . 0.88 109.142 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.468 ' O ' ' O ' ' B' ' 64' ' ' ILE . 29.4 m -109.32 130.08 55.5 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.61 -0.681 . . . . 0.7 109.26 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 38.2 mt -67.49 -32.87 73.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.214 -0.929 . . . . 0.61 109.904 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -60.41 -25.97 66.34 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.302 -0.874 . . . . 1.31 109.839 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.487 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.4 mm -128.88 139.86 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 109.462 -0.57 . . . . 0.15 109.462 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.8 m -100.22 127.77 46.43 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -79.47 142.37 35.91 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.811 -1.181 . . . . 0.2 111.161 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.435 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.3 m95 -78.09 -12.19 59.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.254 -0.904 . . . . 0.21 109.435 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -55.25 -10.97 0.65 Allowed 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.263 -1.014 . . . . 0.49 108.263 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.429 ' H ' ' C ' ' B' ' 67' ' ' TRP . 31.3 m -64.36 134.68 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 109.161 -0.681 . . . . 1.04 109.161 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -60.17 -38.02 81.92 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.073 -1.017 . . . . 1.36 109.018 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.077 -1.609 . . . . 2.32 109.077 -179.513 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 tpt . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.092 -0.707 . . . . 2.88 109.092 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.3 t -98.11 145.44 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.272 -0.893 . . . . 0.45 109.471 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -130.07 128.29 41.61 Favored 'General case' 0 N--CA 1.5 2.041 0 N-CA-C 108.214 -1.032 . . . . 1.67 108.214 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -97.07 125.23 41.39 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.202 -0.937 . . . . 0.31 109.341 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 mm -103.64 115.76 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 108.663 -0.866 . . . . 0.19 108.663 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -99.32 -0.16 41.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.137 -0.977 . . . . 2.25 109.778 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.87 155.58 37.34 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.726 -1.234 . . . . 0.15 111.068 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -65.0 -31.5 72.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.461 -0.94 . . . . 1.65 108.461 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.5 m -58.65 -47.99 82.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 0.23 109.157 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.74 66.11 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.277 -0.889 . . . . 0.17 109.143 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.504 ' CE2' HD11 ' A' ' 15' ' ' LEU . 50.4 t80 -60.05 -44.37 94.74 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.098 -1.001 . . . . 0.14 108.741 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -64.75 -43.04 94.6 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.855 -0.795 . . . . 1.31 108.855 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.01 -36.49 84.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.203 0.525 . . . . 1.77 110.487 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.08 -42.05 80.96 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.266 -0.896 . . . . 0.15 109.221 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.504 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.6 mt -60.26 -40.1 89.16 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.602 -0.888 . . . . 0.17 108.602 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -67.98 -36.78 80.6 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.485 0.66 . . . . 1.07 110.337 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.71 -39.2 84.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.485 -0.759 . . . . 0.18 110.56 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.89 -32.16 71.62 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.234 -0.916 . . . . 0.17 109.45 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.09 -124.91 17.83 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.809 -1.316 . . . . 0.2 109.809 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -91.77 4.02 53.77 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.109 -1.23 . . . . 1.07 110.367 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -76.2 147.89 38.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.047 -1.033 . . . . 1.5 109.482 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.646 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.25 158.69 8.7 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.249 -1.389 . . . . 0.47 107.249 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.644 ' H ' HD23 ' A' ' 22' ' ' LEU . 88.3 t -146.07 113.09 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.633 -1.292 . . . . 0.17 108.873 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 79' ' ' PHE . 41.1 t -99.69 141.33 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 108.401 -0.962 . . . . 0.14 108.401 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.8 t -124.1 123.72 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.196 -0.94 . . . . 0.13 109.681 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.8 t70 -100.98 116.66 33.34 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.407 -0.808 . . . . 1.05 110.687 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -94.41 24.2 4.68 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.23 -0.919 . . . . 0.73 110.991 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -59.56 149.28 30.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 120.756 -1.215 . . . . 0.3 110.647 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.746 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.06 124.8 32.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.175 -1.417 . . . . 0.22 107.175 178.497 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.35 -30.38 70.76 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 118.896 -1.121 . . . . 0.3 108.042 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.746 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.0 p-90 -75.7 -13.85 60.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.423 -0.798 . . . . 0.26 110.741 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.429 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 23.3 t -85.78 118.3 25.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.745 -1.222 . . . . 0.26 108.225 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.42 -54.08 38.98 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 120.73 -0.748 . . . . 0.23 112.265 -177.944 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.7 Cg_endo -60.44 -29.86 89.6 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 CA-C-N 119.539 1.669 . . . . 0.31 112.183 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -76.2 -47.77 22.87 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.015 -1.053 . . . . 0.24 109.726 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -60.05 -32.11 70.61 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.252 -0.905 . . . . 1.59 109.787 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.409 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 44.6 ttm -59.93 -29.3 68.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.506 -0.746 . . . . 2.1 110.12 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -79.76 -4.52 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.701 -0.624 . . . . 0.49 111.026 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.532 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.53 -31.24 8.53 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 120.188 -1.57 . . . . 0.8 113.712 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.1 Cg_exo -59.63 -38.85 79.19 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 CA-C-N 121.756 1.663 . . . . 0.28 112.159 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -71.23 -50.69 30.36 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 118.763 -1.175 . . . . 0.37 108.894 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -59.97 -47.35 86.18 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.099 -1.001 . . . . 0.16 109.178 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -68.91 -42.37 76.97 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.588 -0.695 . . . . 0.32 111.282 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 66.3 m -65.91 -39.15 90.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.905 -1.122 . . . . 0.22 110.622 -179.23 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.93 -22.46 62.47 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.201 -0.937 . . . . 0.22 110.308 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -56.76 -35.27 68.44 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.855 -1.153 . . . . 0.16 108.835 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -89.48 -12.62 39.57 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.957 -1.089 . . . . 2.16 109.503 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 ttmm -81.84 -36.08 28.68 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.182 -1.414 . . . . 1.78 107.182 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -122.09 67.34 0.92 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 107.284 -1.376 . . . . 0.25 107.284 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 p -63.61 -7.03 6.17 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 107.841 -1.17 . . . . 0.22 107.841 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.19 -20.0 45.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.231 -0.655 . . . . 1.13 109.231 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.544 HG13 ' HB3' ' A' ' 22' ' ' LEU . 78.7 t -110.54 147.69 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 108.881 -0.785 . . . . 0.24 108.881 -178.975 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.0 mm -100.1 120.51 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.2 -0.937 . . . . 0.15 109.325 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.576 ' C ' HD12 ' A' ' 55' ' ' LEU . 24.4 m-85 -98.38 126.97 44.11 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.168 -0.957 . . . . 0.12 110.393 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -110.31 143.69 40.14 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 108.616 -0.883 . . . . 0.22 108.616 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -112.33 129.4 56.31 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 106.809 -1.552 . . . . 1.13 106.809 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.5 t -126.93 133.39 68.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.237 -0.914 . . . . 0.15 110.495 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.521 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 51.5 t0 -96.92 120.07 36.58 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.848 -0.797 . . . . 1.05 108.848 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.92 -18.88 24.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.592 -1.318 . . . . 0.16 107.739 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.2 m-20 -90.45 -43.89 9.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.504 -0.747 . . . . 1.08 111.599 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 23.9 m-20 -95.75 -19.04 19.97 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.625 -1.297 . . . . 1.07 108.81 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -119.61 38.75 3.8 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.641 -1.244 . . . . 0.14 107.641 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -60.08 -22.56 62.89 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.835 -0.541 . . . . 1.47 109.933 -178.502 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.617 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.4 p30 -65.42 -38.32 89.57 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.76 -1.213 . . . . 1.05 108.84 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.617 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -71.41 -44.03 72.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 O-C-N 121.234 -0.916 . . . . 0.35 109.647 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.52 73.59 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.442 -0.787 . . . . 0.26 110.438 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -60.83 -34.0 73.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.922 -1.111 . . . . 0.24 109.446 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -62.47 -37.77 87.26 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.882 . . . . 2.06 109.184 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.25 0.02 57.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.347 -0.845 . . . . 0.23 110.929 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 mp0 53.61 49.85 18.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.946 -1.096 . . . . 2.02 109.025 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.08 134.18 29.12 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 O-C-N 121.0 -1.063 . . . . 0.16 108.441 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -105.44 -12.78 15.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.584 -0.698 . . . . 1.6 110.339 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.61 154.44 18.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.819 -1.176 . . . . 0.14 111.116 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -125.8 156.11 71.73 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.359 -1.349 . . . . 0.15 107.359 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -77.66 142.77 72.11 Favored 'Cis proline' 0 C--N 1.316 -1.17 0 C-N-CA 123.644 -1.399 . . . . 0.16 112.074 -2.177 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.9 134.04 48.11 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 109.245 -0.65 . . . . 0.13 109.245 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.535 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 90.9 m-85 -110.7 130.49 55.56 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.72 -0.845 . . . . 0.2 108.72 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -120.63 140.26 51.81 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.397 -0.964 . . . . 0.29 108.397 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.424 ' CE1' HG21 ' A' ' 100' ' ' THR . 76.0 m-85 -107.71 132.12 53.7 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.466 0.651 . . . . 0.14 110.388 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -125.79 144.11 50.78 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.803 -0.814 . . . . 0.15 108.803 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -147.07 128.51 14.96 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.208 -1.404 . . . . 1.68 107.208 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 mttt 60.01 28.03 17.51 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.129 -1.063 . . . . 1.22 108.129 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.19 21.66 75.32 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 110.133 -1.187 . . . . 0.23 110.133 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 40.3 mm-40 -128.72 137.75 51.76 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.291 -1.123 . . . . 2.07 111.012 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -77.43 125.3 29.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.46 -0.775 . . . . 1.82 109.63 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -123.97 9.1 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.617 -0.677 . . . . 0.3 110.887 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.62 154.47 12.31 Favored Glycine 0 N--CA 1.496 2.695 0 C-N-CA 118.424 -1.846 . . . . 0.17 111.538 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -166.54 150.34 7.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.635 -0.921 . . . . 1.93 109.488 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.4 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 27.0 p90 -164.33 161.94 22.05 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.273 -0.971 . . . . 0.14 109.159 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -126.64 159.96 32.1 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.669 0.747 . . . . 0.12 109.539 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.439 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.09 142.85 6.38 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.897 -1.681 . . . . 0.12 108.897 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.98 67.86 4.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.151 -1.205 . . . . 0.18 110.142 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.0 t-20 -119.51 97.19 5.53 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.417 -0.957 . . . . 0.88 108.417 178.789 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -35.43 77.4 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.098 -1.001 . . . . 1.06 111.335 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -61.81 -29.95 70.5 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.982 -1.074 . . . . 1.61 109.388 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -62.46 -33.61 75.16 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.75 -0.594 . . . . 1.45 109.404 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.42 HD21 ' CD1' ' A' ' 77' ' ' PHE . 38.5 mt -59.27 -39.72 83.8 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.974 -1.121 . . . . 0.19 107.974 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.88 -44.06 97.62 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.456 -0.898 . . . . 2.1 110.907 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.89 75.32 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.89 -1.131 . . . . 0.19 110.732 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.424 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.8 m -64.75 -40.59 95.55 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.833 -1.167 . . . . 0.2 109.015 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 77.6 mt -64.46 -47.85 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 N-CA-C 107.586 -1.264 . . . . 0.16 107.586 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.441 ' O ' HG12 ' A' ' 105' ' ' VAL . 48.5 t30 -59.99 -36.4 77.11 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.48 -0.933 . . . . 0.95 108.48 178.94 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -69.33 -40.23 77.71 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.684 -0.635 . . . . 2.21 110.483 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HB2' HD11 ' A' ' 22' ' ' LEU . 94.2 mt -98.22 -2.91 38.61 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.245 -0.91 . . . . 0.25 111.554 -178.514 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.418 -1.426 . . . . 1.08 109.289 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo . . . . . 0 N--CA 1.493 1.448 0 CA-C-O 120.907 0.294 . . . . 1.46 112.333 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.34 123.1 38.69 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.918 -1.114 . . . . 0.88 109.286 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.536 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.4 m -110.49 130.65 55.51 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.464 -0.772 . . . . 0.7 108.93 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.76 -25.21 68.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.303 -0.873 . . . . 0.61 109.287 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.536 ' H ' HG22 ' B' ' 61' ' ' THR . 68.6 mmtt -61.49 -19.4 62.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.316 -0.865 . . . . 1.31 108.754 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.439 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.6 mm -130.22 140.36 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 109.375 -0.602 . . . . 0.15 109.375 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.8 m -100.83 130.06 46.79 Favored 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 106.779 -1.563 . . . . 0.19 106.779 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.1 m -81.99 145.57 30.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.664 -1.272 . . . . 0.2 111.509 -177.821 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.448 ' C ' ' N ' ' B' ' 69' ' ' VAL . 24.7 m95 -80.0 -17.75 52.04 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.411 -0.806 . . . . 0.21 109.563 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 31.9 m-20 -55.98 -12.0 1.27 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.176 -1.046 . . . . 0.49 108.176 179.626 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.448 ' N ' ' C ' ' B' ' 67' ' ' TRP . 7.5 p -64.9 139.37 21.51 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 N-CA-C 109.068 -0.715 . . . . 1.04 109.068 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -59.91 -39.03 84.04 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.094 -1.003 . . . . 1.36 109.769 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 71' ' ' GLY . . . . . 0.422 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 109.429 -1.468 . . . . 2.32 109.429 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.259 -0.645 . . . . 2.88 109.259 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t -98.71 141.48 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.125 0 O-C-N 121.361 -0.837 . . . . 0.45 109.86 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -130.43 129.54 43.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.287 -0.883 . . . . 1.67 108.916 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.423 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 66.3 tt0 -96.52 124.48 40.52 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.777 -1.194 . . . . 0.31 107.777 178.497 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.9 mm -102.03 115.06 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 0.19 108.893 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.423 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 30.9 mm-40 -99.17 -1.58 38.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.289 -0.882 . . . . 2.25 109.279 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 78.9 p -150.13 152.7 35.14 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.13 -0.981 . . . . 0.15 110.993 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' NZ ' ' CB ' ' A' ' 8' ' ' LYS . 2.9 ttmp? -62.83 -31.02 71.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.54 -0.911 . . . . 1.65 108.54 178.372 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.6 m -58.16 -48.62 79.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.106 -0.996 . . . . 0.23 109.495 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.06 70.56 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.257 -0.902 . . . . 0.17 108.872 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.531 ' CE2' HD11 ' A' ' 15' ' ' LEU . 50.1 t80 -59.79 -44.3 93.99 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.825 . . . . 0.14 109.183 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -65.6 -42.35 91.77 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.69 0.757 . . . . 1.31 109.166 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -64.23 -39.1 93.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.641 -0.662 . . . . 1.77 110.226 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.54 85.13 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.417 -0.802 . . . . 0.15 109.029 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.531 HD11 ' CE2' ' A' ' 11' ' ' PHE . 71.4 mt -60.62 -40.15 90.8 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.239 -0.985 . . . . 0.17 108.357 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -69.52 -36.7 76.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.235 -0.916 . . . . 1.07 109.872 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.95 -36.51 78.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.299 -0.876 . . . . 0.18 110.335 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.75 -33.59 75.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.263 -0.898 . . . . 0.17 109.383 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -124.58 20.44 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.345 -1.102 . . . . 0.2 110.345 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -92.52 3.12 56.12 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.124 -1.221 . . . . 1.07 110.83 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -75.14 150.74 38.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.106 -0.996 . . . . 1.5 108.767 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.694 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.38 155.54 24.93 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.823 -1.177 . . . . 0.47 107.823 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.694 ' H ' HD23 ' A' ' 22' ' ' LEU . 46.8 t -142.84 113.17 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 121.128 -0.983 . . . . 0.17 108.695 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -102.08 140.97 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 107.908 -1.145 . . . . 0.14 107.908 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.98 123.68 67.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.351 -0.843 . . . . 0.13 109.572 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.529 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.4 t70 -100.62 109.25 21.31 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.573 -0.704 . . . . 1.05 110.922 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -91.0 101.28 14.05 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 106.575 -1.639 . . . . 0.73 106.575 176.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -128.14 146.48 50.69 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.326 -0.99 . . . . 0.3 108.326 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.564 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.95 123.63 30.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.164 -1.421 . . . . 0.22 107.164 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.0 -32.09 73.08 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 118.522 -1.271 . . . . 0.3 108.545 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.564 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.2 p-90 -70.57 -26.16 63.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.257 -0.902 . . . . 0.26 110.636 179.313 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -83.78 115.98 22.49 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.959 -1.088 . . . . 0.26 108.134 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.468 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -63.28 -50.05 65.85 Favored Glycine 0 N--CA 1.489 2.182 0 C-N-CA 120.622 -0.799 . . . . 0.23 111.713 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 38.6 Cg_exo -52.13 -35.88 64.17 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 CA-C-N 118.913 1.357 . . . . 0.31 111.98 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.81 -53.83 7.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.434 -0.792 . . . . 0.24 110.029 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ttpp -61.11 -37.21 81.96 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.06 -1.025 . . . . 1.59 109.867 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.497 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.6 tmm? -59.2 -28.17 66.41 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.569 -0.707 . . . . 2.1 109.878 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 38' ' ' ILE . 72.9 mt -81.69 -3.86 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.838 -0.539 . . . . 0.49 111.332 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -64.88 -27.6 2.37 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 120.368 -1.458 . . . . 0.8 113.865 -178.022 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.2 Cg_exo -56.15 -40.69 83.23 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 CA-C-N 122.215 1.827 . . . . 0.28 112.604 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -67.92 -45.21 75.01 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 117.817 -1.553 . . . . 0.37 107.877 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -60.29 -53.43 57.79 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.255 -0.903 . . . . 0.16 110.177 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -68.23 -40.09 82.13 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.517 -0.739 . . . . 0.32 110.598 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 70.0 m -62.21 -38.96 91.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.093 -1.004 . . . . 0.22 110.096 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.13 -27.28 68.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.174 -0.954 . . . . 0.22 110.105 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.7 m -50.72 -38.48 47.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.864 -1.147 . . . . 0.16 109.424 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -83.3 -13.17 55.72 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.967 -1.083 . . . . 2.16 109.377 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.457 ' HZ2' ' HB2' ' A' ' 48' ' ' LYS . 4.4 ttmp? -82.05 -36.91 27.22 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.705 -1.22 . . . . 1.78 107.705 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -123.44 65.82 1.01 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 106.509 -1.663 . . . . 0.25 106.509 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.9 p -62.56 -8.87 7.12 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.154 -1.054 . . . . 0.22 108.154 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -89.9 8.44 32.18 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 1.13 108.48 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.2 t -127.27 148.93 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 107.698 -1.223 . . . . 0.24 107.698 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' CD1' ' A' ' 55' ' ' LEU . 21.9 mm -99.88 121.08 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.049 -1.032 . . . . 0.15 109.945 -178.311 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.525 ' C ' HD12 ' A' ' 55' ' ' LEU . 55.6 m-85 -104.45 124.6 49.54 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.201 -0.937 . . . . 0.12 109.909 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.525 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.9 mp -110.5 143.62 40.58 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.952 -1.092 . . . . 0.22 109.833 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -112.8 130.05 56.22 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.74 -1.578 . . . . 1.13 106.74 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.08 140.43 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.916 0.865 . . . . 0.15 111.537 -177.458 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.489 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.3 t0 -102.7 118.07 36.03 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.633 -0.877 . . . . 1.05 108.633 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.0 m -69.73 -15.09 19.04 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 120.697 -1.252 . . . . 0.16 108.794 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.403 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.6 m-20 -95.42 -41.69 8.86 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.457 -0.777 . . . . 1.08 111.047 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 59.1 m-20 -97.53 -18.66 18.85 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.072 -1.018 . . . . 1.07 108.552 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.66 39.15 4.0 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 107.223 -1.399 . . . . 0.14 107.223 178.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.588 ' CD ' ' H ' ' A' ' 63' ' ' GLN . 0.0 OUTLIER -60.16 -22.96 63.53 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.779 -0.646 . . . . 1.47 110.019 -178.927 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.632 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -63.2 -36.21 82.87 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.943 -1.098 . . . . 1.05 109.202 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.632 HG23 ' OD1' ' A' ' 64' ' ' ASP . 13.8 t -73.64 -43.91 53.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.465 -0.772 . . . . 0.35 109.71 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.33 -39.06 68.47 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.768 -0.582 . . . . 0.26 111.309 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.3 p -60.21 -38.78 84.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.978 -1.076 . . . . 0.24 109.946 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.91 -36.5 84.13 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 2.06 109.206 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.03 -0.63 55.07 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.395 -0.816 . . . . 0.23 111.194 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.69 49.84 17.16 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.939 -1.101 . . . . 2.02 109.785 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.6 t -65.38 130.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 C-N-CA 118.329 -1.348 . . . . 0.16 108.276 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -102.15 -12.71 17.85 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.72 -0.613 . . . . 1.6 110.237 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.477 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.82 156.21 17.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.746 -1.221 . . . . 0.14 110.814 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.42 HG23 ' NE1' ' B' ' 67' ' ' TRP . 36.6 p -129.74 154.27 80.96 Favored Pre-proline 0 N--CA 1.504 2.23 0 N-CA-C 108.06 -1.089 . . . . 0.15 108.06 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -74.8 144.95 82.59 Favored 'Cis proline' 0 N--CA 1.496 1.665 0 C-N-CA 123.811 -1.329 . . . . 0.16 112.435 -2.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -130.33 136.12 48.79 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 108.57 -0.9 . . . . 0.13 108.57 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.84 ' CD1' HD21 ' A' ' 97' ' ' LEU . 88.5 m-85 -109.68 129.54 55.59 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.663 -0.648 . . . . 0.2 109.313 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -121.96 137.58 54.74 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.683 -0.858 . . . . 0.29 108.683 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -105.26 133.77 49.48 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.735 -0.603 . . . . 0.14 110.271 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -127.43 143.96 51.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.15 109.357 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -145.92 127.13 14.77 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 107.868 -1.16 . . . . 1.68 107.868 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.2 mttt 59.75 28.51 17.98 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.211 -1.033 . . . . 1.22 108.211 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.07 22.52 73.79 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.757 -1.337 . . . . 0.23 109.757 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 41.1 mm-40 -127.75 137.26 52.37 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.347 -1.09 . . . . 2.07 110.61 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -81.04 126.31 31.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.202 -0.936 . . . . 1.82 109.76 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.26 8.33 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.671 -0.643 . . . . 0.3 110.399 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.89 155.98 16.86 Favored Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.626 -1.749 . . . . 0.17 111.815 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -166.16 149.18 7.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.92 -0.753 . . . . 1.93 109.454 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.42 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 20.6 p90 -164.15 160.68 21.68 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.08 -1.048 . . . . 0.14 109.459 177.927 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -124.96 162.79 23.72 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.615 0.722 . . . . 0.12 109.86 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.523 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.55 137.57 5.53 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.135 -1.586 . . . . 0.12 109.135 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.469 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.02 67.78 2.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.179 -1.189 . . . . 0.18 110.232 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -119.21 100.12 7.13 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.256 -1.016 . . . . 0.88 108.256 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.89 -34.7 73.89 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.492 -0.755 . . . . 1.06 112.36 -178.413 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.03 -29.89 71.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.538 -1.351 . . . . 1.61 109.553 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.83 -38.38 81.87 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.926 -0.768 . . . . 1.45 108.926 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.84 HD21 ' CD1' ' A' ' 77' ' ' PHE . 42.9 mt -57.76 -39.88 78.43 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.853 0.835 . . . . 0.19 108.929 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.81 -41.59 99.36 Favored 'General case' 0 C--N 1.293 -1.873 0 C-N-CA 119.825 -0.75 . . . . 2.1 110.611 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.01 77.28 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.106 -0.996 . . . . 0.19 111.861 -178.676 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -39.58 93.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 120.544 -1.348 . . . . 0.2 109.67 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.5 mt -61.05 -49.9 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.101 -0.999 . . . . 0.16 108.818 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 105' ' ' VAL . 24.0 t-20 -60.18 -34.39 73.53 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.32 -0.992 . . . . 0.95 108.32 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -67.83 -38.5 83.28 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.696 -0.627 . . . . 2.21 109.752 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.621 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.5 mt -101.99 -0.13 34.23 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.299 -0.875 . . . . 0.25 111.56 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.3 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 1.08 109.232 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo . . . . . 0 N--CA 1.494 1.524 0 CA-C-O 121.342 0.476 . . . . 1.46 112.282 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.31 128.58 34.94 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.134 -0.979 . . . . 0.88 109.61 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.433 ' O ' ' O ' ' B' ' 64' ' ' ILE . 24.8 m -111.57 129.27 56.12 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.526 -0.734 . . . . 0.7 109.159 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.7 -30.25 70.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.204 -0.935 . . . . 0.61 109.59 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.405 ' H ' HG22 ' B' ' 61' ' ' THR . 62.1 mmtt -64.16 -20.3 65.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.376 -0.828 . . . . 1.31 109.49 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.523 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.1 mm -130.25 140.47 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.865 -0.522 . . . . 0.15 110.057 -179.266 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 59.9 m -98.15 124.64 42.8 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 107.325 -1.361 . . . . 0.19 107.325 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 60.9 m -77.65 141.55 39.36 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.942 -1.098 . . . . 0.2 111.575 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.464 ' C ' ' N ' ' B' ' 69' ' ' VAL . 21.5 m95 -76.38 -9.57 58.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.21 109.274 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 22.2 m-20 -52.7 -11.52 0.22 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.109 -0.994 . . . . 0.49 108.715 -179.893 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.464 ' N ' ' C ' ' B' ' 67' ' ' TRP . 23.4 m -61.01 145.09 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.367 -0.833 . . . . 1.04 109.692 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -59.48 -36.8 76.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 1.36 109.624 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.903 -1.498 . . . . 2.32 109.685 179.723 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mmm . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.021 -0.733 . . . . 2.88 109.021 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.1 t -98.83 132.88 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.3 -0.875 . . . . 0.45 109.41 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -132.01 130.68 41.72 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.617 -0.883 . . . . 1.67 108.617 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -99.35 122.86 43.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.348 -0.845 . . . . 0.31 108.886 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.69 115.25 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.372 -0.83 . . . . 0.19 108.792 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.457 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 53.4 mp0 -97.52 -0.71 45.5 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.376 -0.827 . . . . 2.25 109.415 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -154.0 153.11 31.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.021 -1.049 . . . . 0.15 111.198 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.84 -32.4 73.61 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.445 -0.946 . . . . 1.65 108.445 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.3 m -58.96 -46.44 88.06 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.999 -1.111 . . . . 0.23 107.999 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.92 -30.7 69.22 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.634 -0.876 . . . . 0.17 108.634 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.515 ' CE2' HD11 ' A' ' 15' ' ' LEU . 53.7 t80 -59.83 -43.79 94.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.109 -0.994 . . . . 0.14 108.964 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -65.36 -41.29 94.0 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.831 -0.803 . . . . 1.31 108.831 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.9 -35.34 79.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.663 -0.648 . . . . 1.77 110.237 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.81 82.92 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.284 -0.885 . . . . 0.15 109.234 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.515 HD11 ' CE2' ' A' ' 11' ' ' PHE . 69.3 mt -61.52 -40.39 94.45 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.334 -0.854 . . . . 0.17 108.807 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -70.05 -36.83 75.29 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.417 -0.802 . . . . 1.07 110.185 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.11 90.14 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.361 -0.837 . . . . 0.18 110.338 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -32.66 71.52 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.381 -0.824 . . . . 0.17 109.847 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.08 -126.8 23.75 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.31 -1.116 . . . . 0.2 110.31 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -91.75 5.27 50.45 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.892 -1.358 . . . . 1.07 110.978 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -77.58 151.83 34.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.128 -0.983 . . . . 1.5 109.469 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.677 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -61.03 156.91 16.76 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.489 -1.3 . . . . 0.47 107.489 179.78 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.675 ' H ' HD23 ' A' ' 22' ' ' LEU . 77.8 t -143.75 117.99 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.856 -1.153 . . . . 0.17 108.859 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.0 142.08 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 107.813 -1.18 . . . . 0.14 107.813 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.45 123.76 66.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.351 -0.843 . . . . 0.13 109.205 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.473 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.1 t70 -100.82 118.1 36.22 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.473 -0.767 . . . . 1.05 109.633 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -95.18 22.8 6.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.306 -0.871 . . . . 0.73 109.902 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.3 m -59.04 148.01 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.027 -1.045 . . . . 0.3 110.779 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.583 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.13 123.82 32.6 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.074 -1.084 . . . . 0.22 108.074 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.0 t -65.26 -34.51 78.52 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 118.916 -1.114 . . . . 0.3 108.192 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.583 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.0 p-90 -70.12 -23.28 63.0 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.218 -0.927 . . . . 0.26 111.003 179.032 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.2 t -82.68 112.89 19.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.734 -1.229 . . . . 0.26 107.992 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.455 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.85 -50.58 66.17 Favored Glycine 0 N--CA 1.489 2.211 0 C-N-CA 120.329 -0.939 . . . . 0.23 111.246 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.1 Cg_exo -51.45 -37.82 62.51 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 CA-C-N 119.011 1.406 . . . . 0.31 111.958 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.444 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.49 -47.5 19.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.057 -1.027 . . . . 0.24 109.909 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.54 -31.52 69.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.135 -0.978 . . . . 1.59 109.127 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.511 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -59.91 -29.74 68.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.473 -0.767 . . . . 2.1 109.967 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.558 HD11 ' HB1' ' A' ' 92' ' ' ALA . 15.5 mt -80.78 -5.07 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.523 -0.736 . . . . 0.49 111.325 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.526 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.28 -31.52 9.36 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 119.988 -1.695 . . . . 0.8 113.669 -176.857 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -59.9 -37.46 85.66 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 CA-C-N 121.898 1.714 . . . . 0.28 112.067 -178.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -71.62 -51.4 23.41 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 118.371 -1.332 . . . . 0.37 108.175 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.87 -46.7 88.46 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.38 -0.825 . . . . 0.16 109.039 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.14 -45.65 73.02 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.493 -0.755 . . . . 0.32 110.846 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.7 m -61.62 -39.92 93.0 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.085 -1.009 . . . . 0.22 111.154 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.6 mt -61.33 -22.31 64.79 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.269 -0.894 . . . . 0.22 110.852 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -55.51 -38.25 68.96 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 120.981 -1.074 . . . . 0.16 108.714 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -86.21 -16.66 37.03 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.251 -0.905 . . . . 2.16 109.263 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -76.58 -35.75 57.96 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.325 -1.361 . . . . 1.78 107.325 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -123.9 67.92 1.04 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 107.552 -1.277 . . . . 0.25 107.552 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.7 p -64.06 -7.73 9.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.578 -0.897 . . . . 0.22 108.578 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -89.16 5.48 44.46 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.115 -1.069 . . . . 1.13 108.115 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.473 HG13 ' HB3' ' A' ' 22' ' ' LEU . 44.4 t -128.0 143.08 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 N-CA-C 107.605 -1.257 . . . . 0.24 107.605 178.796 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.5 mm -99.21 122.55 51.1 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.913 -1.117 . . . . 0.15 109.203 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.599 ' C ' HD12 ' A' ' 55' ' ' LEU . 29.8 m-85 -100.76 129.01 46.59 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.298 -0.876 . . . . 0.12 109.219 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.599 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -112.52 141.52 46.19 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.357 -0.839 . . . . 0.22 109.138 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -109.94 132.62 53.99 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.673 -1.603 . . . . 1.13 106.673 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -130.45 132.0 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.27 -0.894 . . . . 0.15 110.26 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.665 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.6 t0 -95.64 120.96 36.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 1.05 108.52 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.87 -20.52 26.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 120.659 -1.276 . . . . 0.16 107.989 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.543 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.1 m-20 -90.25 -43.2 10.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.618 -0.676 . . . . 1.08 111.506 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.411 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 72.4 m-20 -95.75 -14.2 23.54 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.561 -1.337 . . . . 1.07 108.237 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.665 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 39.72 3.9 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.21 -1.404 . . . . 0.14 107.21 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -60.08 -26.93 66.58 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.628 -0.67 . . . . 1.47 109.362 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.537 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -65.33 -37.48 87.21 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.029 -1.044 . . . . 1.05 108.969 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.537 HG23 ' OD1' ' A' ' 64' ' ' ASP . 7.6 t -70.28 -47.26 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.236 -0.915 . . . . 0.35 109.797 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.33 -36.92 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.446 -0.784 . . . . 0.26 110.788 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -61.07 -32.59 72.23 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.027 -1.046 . . . . 0.24 109.57 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.9 -35.73 80.68 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.246 -0.908 . . . . 2.06 109.283 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.467 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -88.02 -0.22 56.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.281 -0.887 . . . . 0.23 110.857 -178.952 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 54.62 50.06 16.77 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.056 -1.027 . . . . 2.02 109.954 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.2 t -67.45 132.38 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 120.938 -1.101 . . . . 0.16 108.731 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -104.6 -12.63 16.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.671 -0.643 . . . . 1.6 110.66 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.8 153.42 16.77 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.499 -1.376 . . . . 0.14 110.841 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -124.84 155.26 70.43 Favored Pre-proline 0 N--CA 1.501 2.122 0 N-CA-C 108.038 -1.097 . . . . 0.15 108.038 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -76.44 143.16 75.38 Favored 'Cis proline' 0 N--CA 1.493 1.457 0 C-N-CA 123.844 -1.315 . . . . 0.16 112.538 -2.914 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.9 m -128.97 136.12 49.92 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.11 -0.7 . . . . 0.13 109.11 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.756 ' CD1' HD21 ' A' ' 97' ' ' LEU . 93.8 m-85 -112.01 129.64 56.13 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.778 -0.823 . . . . 0.2 108.778 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.467 HE22 ' HB1' ' A' ' 69' ' ' ALA . 63.0 mt-30 -121.49 137.75 54.59 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.843 -1.169 . . . . 0.29 107.843 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -105.56 134.59 48.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.722 -0.611 . . . . 0.14 110.978 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -128.1 148.99 50.6 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.47 0.653 . . . . 0.15 109.546 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -150.74 125.62 9.79 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.74 -1.207 . . . . 1.68 107.74 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 55.1 mttp 60.03 28.17 17.68 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 108.956 -0.757 . . . . 1.22 108.956 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.2 21.46 70.38 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.113 -1.195 . . . . 0.23 110.113 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 92.9 mt-30 -129.51 140.21 51.32 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.328 -1.101 . . . . 2.07 110.596 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -77.79 129.12 35.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.551 -0.718 . . . . 1.82 109.063 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.4 m -123.24 8.03 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.683 -0.636 . . . . 0.3 110.39 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.81 14.6 Favored Glycine 0 N--CA 1.497 2.704 0 C-N-CA 118.433 -1.842 . . . . 0.17 112.059 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -164.13 149.44 10.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 122.005 -0.703 . . . . 1.93 109.87 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 8.2 p90 -163.81 159.57 21.37 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.389 -0.82 . . . . 0.14 109.967 177.693 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.4 p -126.2 160.46 30.2 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.867 0.842 . . . . 0.12 110.253 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.492 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.34 140.78 5.6 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.652 -1.779 . . . . 0.12 108.652 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.558 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.32 62.91 3.8 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.184 -1.186 . . . . 0.18 110.193 -179.338 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.4 t-20 -117.48 101.82 8.69 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.89 -1.152 . . . . 0.88 107.89 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.453 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.32 -31.45 69.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.484 -0.76 . . . . 1.06 111.747 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.94 -29.56 69.46 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.721 -1.237 . . . . 1.61 109.551 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.429 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 74.4 tttt -60.07 -34.09 72.97 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 108.353 -0.98 . . . . 1.45 108.353 -179.25 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.756 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.1 mt -59.87 -40.04 87.3 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.61 -0.885 . . . . 0.19 108.61 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -63.09 -42.4 99.61 Favored 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.916 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.55 78.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.185 -0.947 . . . . 0.19 111.278 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.04 -39.31 90.06 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 120.753 -1.217 . . . . 0.2 109.873 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.4 mt -61.38 -47.49 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.001 -1.062 . . . . 0.16 108.511 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.499 ' O ' HG12 ' A' ' 105' ' ' VAL . 18.9 t-20 -60.41 -35.63 76.24 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 121.821 0.82 . . . . 0.95 108.922 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.29 -39.72 86.01 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.75 -0.594 . . . . 2.21 109.886 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 22' ' ' LEU . 73.4 mt -99.35 -2.65 35.78 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.236 -0.915 . . . . 0.25 111.046 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.3 p . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.521 -1.362 . . . . 1.08 109.019 -179.373 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo . . . . . 0 N--CA 1.496 1.642 0 CA-C-O 121.474 0.531 . . . . 1.46 111.718 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -90.1 124.95 35.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.403 -0.81 . . . . 0.88 108.993 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.41 HG22 ' H ' ' B' ' 63' ' ' LYS . 25.9 m -109.39 126.75 53.76 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.326 -0.859 . . . . 0.7 109.7 -179.221 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -70.65 -25.97 63.24 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.433 -0.792 . . . . 0.61 109.936 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.41 ' H ' HG22 ' B' ' 61' ' ' THR . 28.9 mmtp -65.09 -17.8 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.441 -0.787 . . . . 1.31 109.283 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.492 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.1 mm -129.29 140.1 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 121.813 -0.555 . . . . 0.15 109.821 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.6 m -101.64 132.15 47.47 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.725 -1.213 . . . . 0.19 107.725 178.072 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.0 m -81.66 141.55 33.54 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.726 -1.234 . . . . 0.2 110.994 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.465 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.6 m95 -76.21 -12.55 60.11 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.292 -0.88 . . . . 0.21 108.904 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 49.6 m-20 -53.33 -11.39 0.3 Allowed 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.36 -0.978 . . . . 0.49 108.36 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.458 ' N ' ' C ' ' B' ' 67' ' ' TRP . 13.8 m -60.44 139.6 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 119.544 -0.862 . . . . 1.04 109.563 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -60.43 -37.43 80.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.572 -0.705 . . . . 1.36 110.259 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 118.0 -1.444 . . . . 2.32 109.533 -179.18 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.3 mmm . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.177 -0.675 . . . . 2.88 109.177 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 78.5 t -97.99 145.24 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 O-C-N 121.257 -0.902 . . . . 0.45 109.845 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.4 tptt -129.56 125.34 36.03 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 107.83 -1.174 . . . . 1.67 107.83 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -96.55 122.62 39.66 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.847 -0.798 . . . . 0.31 108.847 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.9 111.95 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 108.487 -0.931 . . . . 0.19 108.487 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.458 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.9 mp0 -95.65 -0.44 51.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.138 -0.976 . . . . 2.25 109.844 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.58 156.3 34.85 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.79 -1.194 . . . . 0.15 111.782 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -61.87 -31.7 71.99 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.225 -1.028 . . . . 1.65 108.225 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.408 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 60.0 m -58.51 -49.91 75.67 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.503 -0.879 . . . . 0.23 108.818 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.03 67.59 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.933 -0.766 . . . . 0.17 108.933 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.579 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.9 t80 -59.75 -44.52 93.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 0.14 109.351 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -65.01 -44.02 90.56 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.424 -0.797 . . . . 1.31 109.305 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.533 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.84 -39.45 94.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.704 -0.623 . . . . 1.77 110.414 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.19 95.36 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.374 -0.829 . . . . 0.15 109.057 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.579 HD11 ' CE2' ' A' ' 11' ' ' PHE . 35.6 mt -60.25 -41.06 92.42 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.315 -0.866 . . . . 0.17 109.011 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -70.02 -36.16 74.87 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.359 -0.838 . . . . 1.07 110.474 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.46 78.71 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.132 -0.98 . . . . 0.18 110.965 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.62 -31.48 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.897 -1.127 . . . . 0.17 109.675 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.95 -124.67 20.83 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.989 -1.244 . . . . 0.2 109.989 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.426 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 65.2 m-20 -91.85 0.33 57.49 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.999 -1.294 . . . . 1.07 110.706 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -74.78 150.1 39.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.838 -1.164 . . . . 1.5 109.646 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 22' ' ' LEU . 8.2 mt -57.39 159.94 4.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.961 -1.087 . . . . 0.47 109.316 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.1 t -146.65 107.92 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 108.102 -1.073 . . . . 0.17 108.102 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.449 HG22 ' CD2' ' A' ' 79' ' ' PHE . 47.6 t -102.46 136.26 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 N-CA-C 107.595 -1.261 . . . . 0.14 107.595 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.9 t -118.18 123.05 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.201 -0.937 . . . . 0.13 109.742 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -98.97 119.78 38.31 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 1.05 109.928 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -97.85 24.91 6.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.23 -0.919 . . . . 0.73 110.401 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -59.88 148.26 35.49 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.036 -1.04 . . . . 0.3 110.403 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.587 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.39 124.54 32.11 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.687 -1.227 . . . . 0.22 107.687 178.623 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.09 -33.61 74.86 Favored 'General case' 0 C--N 1.298 -1.638 0 C-N-CA 118.877 -1.129 . . . . 0.3 108.703 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.587 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.4 p-90 -69.95 -21.63 63.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.147 -0.971 . . . . 0.26 110.447 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.1 t -84.59 112.01 20.04 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.974 -1.079 . . . . 0.26 108.342 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.431 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.92 -52.05 55.57 Favored Glycine 0 N--CA 1.491 2.349 0 C-N-CA 120.862 -0.685 . . . . 0.23 111.64 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -51.23 -35.28 52.21 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 CA-C-N 119.062 1.431 . . . . 0.31 111.72 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.66 17.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.587 -0.696 . . . . 0.24 109.816 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.0 -32.15 70.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.28 -0.887 . . . . 1.59 109.533 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 19.1 ttt -59.81 -27.76 66.87 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 2.1 108.998 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.405 HG22 ' O ' ' A' ' 38' ' ' ILE . 19.5 mt -82.2 -7.72 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.782 -0.574 . . . . 0.49 111.868 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.93 -31.13 8.6 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 119.858 -1.776 . . . . 0.8 114.168 -177.472 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.9 Cg_exo -58.61 -38.61 88.63 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.616 1.613 . . . . 0.28 112.579 -178.06 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -69.29 -51.07 40.9 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 118.773 -1.171 . . . . 0.37 108.954 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.63 -50.81 72.44 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.248 -0.908 . . . . 0.16 109.508 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -67.47 -44.24 79.07 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.744 -0.597 . . . . 0.32 111.522 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.453 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.5 -37.1 84.73 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.953 -1.092 . . . . 0.22 110.496 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.73 -25.42 67.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.22 110.315 -178.584 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.0 m -51.62 -38.35 54.27 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.075 -1.016 . . . . 0.16 108.633 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -85.87 -17.03 36.72 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.4 -0.812 . . . . 2.16 109.415 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -77.66 -37.34 50.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 107.594 -1.261 . . . . 1.78 107.594 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -121.85 67.25 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 106.699 -1.593 . . . . 0.25 106.699 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.5 p -63.44 -10.1 15.74 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.856 -0.794 . . . . 0.22 108.856 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -90.99 8.84 33.26 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.6 -0.889 . . . . 1.13 108.6 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 70.0 t -127.12 145.72 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 107.406 -1.331 . . . . 0.24 107.406 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.31 120.61 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 120.978 -1.076 . . . . 0.15 109.989 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.5 ' C ' HD12 ' A' ' 55' ' ' LEU . 47.6 m-85 -102.96 127.78 50.05 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.006 -1.059 . . . . 0.12 109.891 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.5 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -110.06 141.4 42.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.984 -1.073 . . . . 0.22 109.489 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -110.14 132.88 53.77 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.316 -1.364 . . . . 1.13 107.316 178.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 39.6 t -130.23 131.92 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.157 -0.964 . . . . 0.15 110.839 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.617 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.9 t0 -95.2 119.97 34.62 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.135 -1.061 . . . . 1.05 108.135 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.11 -20.1 25.37 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 C-N-CA 118.749 -1.181 . . . . 0.16 108.532 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.9 m-20 -91.72 -41.36 10.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.486 -0.759 . . . . 1.08 111.806 -178.917 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -95.91 -14.78 22.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 120.408 -1.433 . . . . 1.07 108.236 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.98 38.9 4.09 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.601 -1.259 . . . . 0.14 107.601 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -59.84 -26.58 65.92 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 109.414 -0.587 . . . . 1.47 109.414 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.12 -36.29 83.56 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.804 -1.185 . . . . 1.05 109.495 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.461 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.2 t -73.26 -43.12 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 120.961 -1.087 . . . . 0.35 109.694 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.9 -37.83 67.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.379 -0.826 . . . . 0.26 110.394 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 84.8 p -60.99 -33.91 73.98 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.09 -1.007 . . . . 0.24 108.467 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -60.64 -40.02 90.41 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.538 -0.726 . . . . 2.06 109.056 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.18 4.58 50.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.331 -0.856 . . . . 0.23 110.869 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 52.25 50.13 19.06 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.884 -1.135 . . . . 2.02 110.545 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.35 132.13 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.778 -1.201 . . . . 0.16 108.87 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -103.92 -9.89 18.58 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.719 -0.613 . . . . 1.6 109.611 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.516 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.45 155.79 20.33 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.772 -1.205 . . . . 0.14 111.772 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -126.04 154.3 73.98 Favored Pre-proline 0 N--CA 1.499 1.976 0 N-CA-C 107.566 -1.272 . . . . 0.15 107.566 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -78.86 140.06 56.93 Favored 'Cis proline' 0 N--CA 1.487 1.144 0 C-N-CA 123.657 -1.393 . . . . 0.16 111.97 -2.067 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -124.22 132.89 53.63 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.885 -0.783 . . . . 0.13 108.885 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.524 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.6 m-85 -110.67 131.48 55.01 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.938 -0.764 . . . . 0.2 108.938 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -121.63 140.4 52.31 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.605 -0.887 . . . . 0.29 108.605 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.449 ' CD2' HG22 ' A' ' 24' ' ' VAL . 66.5 m-85 -107.87 131.15 54.8 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.397 0.617 . . . . 0.14 109.679 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -125.62 148.98 48.78 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 109.082 -0.71 . . . . 0.15 109.082 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -147.31 127.74 14.03 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.182 -1.414 . . . . 1.68 107.182 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.426 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 40.4 mttm 56.09 33.26 21.62 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.057 -1.027 . . . . 1.22 108.89 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.56 24.72 76.45 Favored Glycine 0 N--CA 1.484 1.883 0 N-CA-C 109.82 -1.312 . . . . 0.23 109.82 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 37.8 mm-40 -129.23 135.92 49.43 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.513 -0.993 . . . . 2.07 110.809 179.943 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -73.69 129.99 39.07 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.093 -1.004 . . . . 1.82 109.651 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.0 10.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.864 -0.523 . . . . 0.3 110.09 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 164.01 161.78 13.77 Favored Glycine 0 N--CA 1.496 2.658 0 C-N-CA 118.373 -1.87 . . . . 0.17 112.051 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -165.25 154.65 12.65 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.872 -0.781 . . . . 1.93 109.325 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 5.8 p90 -166.92 157.03 11.38 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.886 -0.726 . . . . 0.14 109.355 178.465 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -125.54 160.91 28.38 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.608 -0.682 . . . . 0.12 109.418 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.461 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.7 143.34 6.11 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.532 -1.827 . . . . 0.12 108.532 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.15 64.04 4.85 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.171 -1.193 . . . . 0.18 109.146 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 53.0 t-20 -116.83 98.4 6.48 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 108.336 -0.987 . . . . 0.88 108.336 179.108 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -34.77 72.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.448 -0.782 . . . . 1.06 111.312 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -62.57 -29.37 70.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.206 -0.934 . . . . 1.61 109.257 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -60.9 -37.62 82.87 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.603 -0.686 . . . . 1.45 109.149 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.05 -39.79 83.11 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.232 -1.025 . . . . 0.19 108.232 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.37 -44.01 96.02 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.051 -0.66 . . . . 2.1 110.503 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.64 -44.08 62.37 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.966 -1.084 . . . . 0.19 111.318 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.4 m -63.2 -40.03 96.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.644 -1.285 . . . . 0.2 109.739 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 69.2 mt -62.1 -50.09 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.221 -0.924 . . . . 0.16 108.551 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.402 ' O ' HG12 ' A' ' 105' ' ' VAL . 21.9 t-20 -60.87 -34.35 74.48 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 122.023 0.916 . . . . 0.95 108.758 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -67.61 -39.87 84.74 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.525 -0.734 . . . . 2.21 110.208 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 75.8 mt -101.3 -3.13 29.46 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.019 -1.051 . . . . 0.25 111.493 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.6 p . . . . . 0 N--CA 1.5 2.036 0 O-C-N 120.392 -1.442 . . . . 1.08 109.678 -179.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 N--CA 1.495 1.596 0 CA-C-O 121.212 0.421 . . . . 1.46 111.745 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.86 124.83 39.12 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.212 -0.93 . . . . 0.88 109.503 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.408 ' O ' ' O ' ' B' ' 64' ' ' ILE . 24.0 m -111.18 129.91 55.8 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.815 -0.809 . . . . 0.7 108.815 179.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -65.75 -30.95 71.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 0.61 109.811 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -65.55 -16.6 63.85 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.438 -0.789 . . . . 1.31 109.541 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.461 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.9 mm -130.0 140.78 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 N-CA-C 109.592 -0.521 . . . . 0.15 109.592 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 16.9 m -101.61 129.49 47.74 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 107.159 -1.423 . . . . 0.19 107.159 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.5 m -81.15 143.93 32.03 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.887 -1.133 . . . . 0.2 111.802 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.516 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 27.6 m95 -76.79 -10.92 59.71 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.052 -1.03 . . . . 0.21 109.24 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 41.4 m-20 -53.07 -10.96 0.21 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.625 -0.88 . . . . 0.49 108.625 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.448 ' H ' ' C ' ' B' ' 67' ' ' TRP . 31.0 m -64.34 141.59 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.38 -0.825 . . . . 1.04 109.377 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -59.38 -38.93 81.73 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.436 -0.79 . . . . 1.36 109.434 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 CA-C-O 117.921 -1.488 . . . . 2.32 109.79 -179.847 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.472 ' C ' ' SD ' ' A' ' 1' ' ' MET . 1.4 tmt? . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 108.963 -0.754 . . . . 2.88 108.963 . . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.466 HG21 ' ND1' ' A' ' 43' ' ' HIS . 90.5 t -101.41 154.67 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.372 -0.83 . . . . 0.45 109.747 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.406 ' N ' HG12 ' A' ' 2' ' ' VAL . 21.5 ttpt -130.12 127.37 39.64 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.418 -0.956 . . . . 1.67 108.418 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -94.91 125.31 39.49 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.166 -0.959 . . . . 0.31 109.265 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.4 mm -100.56 116.36 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.404 -0.961 . . . . 0.19 108.404 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -99.64 -2.8 34.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.396 -0.815 . . . . 2.25 109.433 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -152.57 155.99 38.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 119.257 -0.977 . . . . 0.15 111.189 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -62.33 -33.81 75.42 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.924 -1.139 . . . . 1.65 107.924 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.2 m -56.0 -49.39 73.77 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 118.962 -1.095 . . . . 0.23 108.96 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.24 69.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.665 -0.865 . . . . 0.17 108.665 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.55 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.1 t80 -59.77 -43.14 94.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.023 -1.048 . . . . 0.14 109.069 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -65.49 -41.61 93.08 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 108.33 -0.989 . . . . 1.31 108.33 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -66.57 -35.73 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.785 -0.572 . . . . 1.77 109.941 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.919 . . . . 0.15 108.746 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.55 HD11 ' CE2' ' A' ' 11' ' ' PHE . 55.3 mt -61.37 -42.66 99.07 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.419 -0.956 . . . . 0.17 108.419 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -68.49 -37.08 79.79 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.622 -0.674 . . . . 1.07 110.053 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.61 -38.63 84.22 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.336 -0.852 . . . . 0.18 109.64 -179.224 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.82 69.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.119 -0.988 . . . . 0.17 110.331 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -128.05 26.05 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.276 -1.13 . . . . 0.2 110.276 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -91.65 3.48 54.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.141 -1.211 . . . . 1.07 109.957 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.4 mttp -75.16 149.16 39.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.022 -1.048 . . . . 1.5 109.44 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.08 154.9 18.23 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.752 -1.203 . . . . 0.47 107.752 -179.637 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.611 ' H ' HD23 ' A' ' 22' ' ' LEU . 92.5 t -142.57 109.75 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.996 -1.065 . . . . 0.17 108.99 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.3 t -100.12 141.16 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 107.783 -1.191 . . . . 0.14 107.783 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -123.42 121.69 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 O-C-N 120.893 -1.13 . . . . 0.13 109.978 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.563 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.55 121.72 40.85 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.359 -0.838 . . . . 1.05 110.11 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -97.13 21.36 9.97 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.126 -0.984 . . . . 0.73 110.226 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.408 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 52.3 m -54.16 147.06 13.65 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.045 -1.034 . . . . 0.3 111.306 -178.627 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.559 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.94 126.19 33.3 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.843 -1.169 . . . . 0.22 107.843 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.413 HG23 ' N ' ' A' ' 31' ' ' TRP . 7.8 t -66.93 -36.56 82.52 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.646 -1.284 . . . . 0.3 108.477 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.559 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.3 p-90 -69.9 -22.6 63.21 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.333 -0.854 . . . . 0.26 111.761 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.9 t -83.77 118.39 23.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.715 -1.241 . . . . 0.26 108.806 -179.275 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.409 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.06 -54.39 37.14 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 120.1 -1.048 . . . . 0.23 111.074 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 38.5 Cg_exo -50.69 -38.58 56.21 Favored 'Trans proline' 0 C--N 1.309 -1.549 0 CA-C-N 119.074 1.437 . . . . 0.31 111.95 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.72 -49.96 19.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.24 110.504 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -60.42 -38.12 83.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.091 -1.006 . . . . 1.59 109.391 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 22.5 ttt -57.42 -28.61 63.43 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.477 -0.765 . . . . 2.1 110.183 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.56 HG22 ' O ' ' A' ' 38' ' ' ILE . 63.6 mt -85.18 -2.81 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.829 -0.544 . . . . 0.49 111.047 -179.328 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.572 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 3.4 ptmt -64.16 -29.54 3.99 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 120.111 -1.618 . . . . 0.8 112.979 -178.592 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.0 Cg_exo -56.62 -41.67 73.4 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 121.525 1.581 . . . . 0.28 113.116 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.536 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 31.3 m-85 -68.15 -44.7 75.43 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.249 -1.532 . . . . 0.37 108.575 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -61.14 -53.9 51.19 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.79 0.805 . . . . 0.16 110.342 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.466 ' ND1' HG21 ' A' ' 2' ' ' VAL . 49.9 t60 -68.24 -42.27 79.97 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.77 -0.582 . . . . 0.32 111.404 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.4 m -60.52 -37.76 82.2 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.102 -0.999 . . . . 0.22 110.692 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 mt -63.15 -21.74 66.4 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.84 -1.163 . . . . 0.22 110.792 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.0 m -51.56 -39.43 57.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.613 -1.304 . . . . 0.16 108.916 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -82.46 -16.5 48.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.434 -0.791 . . . . 2.16 109.598 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -78.28 -36.68 46.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.091 -1.448 . . . . 1.78 107.091 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -124.18 67.85 1.06 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 107.353 -1.351 . . . . 0.25 107.353 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -63.86 -10.44 20.6 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.574 -0.899 . . . . 0.22 108.574 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -89.25 6.16 41.55 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.349 -0.982 . . . . 1.13 108.349 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.488 HG13 ' HB3' ' A' ' 22' ' ' LEU . 43.4 t -126.07 143.67 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 N-CA-C 107.289 -1.374 . . . . 0.24 107.289 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.6 mm -99.89 120.35 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 121.043 -1.036 . . . . 0.15 110.0 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.41 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.0 m-85 -100.83 128.64 46.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.157 -0.965 . . . . 0.12 109.496 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.41 HD12 ' C ' ' A' ' 54' ' ' PHE . 2.8 mp -110.34 140.01 44.97 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 120.945 -1.097 . . . . 0.22 109.771 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -110.1 132.01 54.54 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.777 -1.564 . . . . 1.13 106.777 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -130.13 130.19 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.06 -1.025 . . . . 0.15 110.437 -178.213 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 47.6 t0 -93.0 121.07 33.96 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.27 -1.011 . . . . 1.05 108.27 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -68.37 -19.0 23.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.689 -1.257 . . . . 0.16 108.362 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.2 m-20 -92.66 -39.83 11.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.45 -0.781 . . . . 1.08 112.126 -179.183 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -98.02 -14.39 20.57 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.708 -1.245 . . . . 1.07 108.199 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -126.83 39.32 3.94 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 107.586 -1.264 . . . . 0.14 107.586 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -59.79 -23.18 63.07 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 115.748 -0.66 . . . . 1.47 110.097 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.616 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -64.36 -39.99 94.97 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.94 -1.1 . . . . 1.05 109.177 179.619 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.616 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -69.54 -45.13 78.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 O-C-N 121.125 -0.985 . . . . 0.35 110.108 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.35 69.75 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.623 -0.673 . . . . 0.26 110.699 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.3 p -60.31 -39.43 86.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.936 -1.103 . . . . 0.24 109.981 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -62.88 -37.08 85.48 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.148 -0.97 . . . . 2.06 109.336 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.404 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.64 0.49 50.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.149 -0.97 . . . . 0.23 110.248 -179.618 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 52.28 50.25 18.79 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.868 -1.145 . . . . 2.02 109.375 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 35.3 t -64.17 134.57 28.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 120.46 -1.4 . . . . 0.16 108.138 -179.007 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -106.51 -12.38 15.63 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.501 -0.749 . . . . 1.6 109.987 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.523 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -161.49 155.02 21.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.96 -1.088 . . . . 0.14 110.378 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.62 155.72 80.8 Favored Pre-proline 0 N--CA 1.506 2.361 0 N-CA-C 107.596 -1.261 . . . . 0.15 107.596 178.539 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -73.03 142.87 76.08 Favored 'Cis proline' 0 N--CA 1.495 1.615 0 CA-C-N 120.22 1.114 . . . . 0.16 112.759 -2.321 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 89.8 m -130.1 129.97 44.24 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.511 -0.922 . . . . 0.13 108.511 178.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.563 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.8 m-85 -106.94 130.32 54.62 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.2 109.741 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.404 HE22 ' HB1' ' A' ' 69' ' ' ALA . 71.7 mt-30 -122.07 139.88 53.19 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.162 -0.961 . . . . 0.29 109.256 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -105.82 137.76 43.15 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.496 0.665 . . . . 0.14 110.448 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.82 150.27 52.06 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.82 -0.807 . . . . 0.15 108.82 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -147.16 129.37 15.64 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.562 -1.273 . . . . 1.68 107.562 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.7 mttt 52.0 32.26 9.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.836 -1.165 . . . . 1.22 109.04 -178.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.83 21.65 76.15 Favored Glycine 0 N--CA 1.483 1.811 0 N-CA-C 110.452 -1.059 . . . . 0.23 110.452 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -127.87 142.48 51.26 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.298 -1.119 . . . . 2.07 110.26 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -76.84 127.34 32.56 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.46 -0.775 . . . . 1.82 109.456 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -121.35 1.56 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.562 -0.711 . . . . 0.3 110.442 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.92 163.69 31.02 Favored Glycine 0 N--CA 1.5 2.903 0 C-N-CA 118.701 -1.714 . . . . 0.17 111.57 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.486 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.4 tp10 -166.7 149.97 6.88 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.53 -0.983 . . . . 1.93 109.178 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.486 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.6 p90 -168.76 157.72 8.56 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.084 -1.01 . . . . 0.14 109.794 177.338 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -126.76 164.51 21.18 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.602 -0.687 . . . . 0.12 109.736 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.47 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 116.37 145.26 8.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.849 -1.301 . . . . 0.12 109.849 179.225 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.433 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -78.77 68.04 4.65 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.552 -0.97 . . . . 0.18 109.524 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.3 t-20 -119.15 91.69 3.62 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 108.334 -0.988 . . . . 0.88 108.334 179.603 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.536 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -67.27 -30.98 71.01 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.636 -0.665 . . . . 1.06 111.55 -178.841 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.2 mp0 -67.42 -30.12 69.78 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.809 -1.182 . . . . 1.61 109.144 179.519 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.35 -35.26 75.25 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.268 -0.895 . . . . 1.45 108.762 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.1 mt -59.56 -38.96 82.5 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.904 0.859 . . . . 0.19 108.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -62.83 -43.38 98.94 Favored 'General case' 0 C--N 1.294 -1.816 0 C-N-CA 119.997 -0.681 . . . . 2.1 111.043 -178.127 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -43.8 70.7 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.114 -0.991 . . . . 0.19 112.032 -178.248 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -63.18 -39.5 94.83 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.943 -1.098 . . . . 0.2 109.996 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.417 ' O ' ' N ' ' A' ' 105' ' ' VAL . 49.4 mt -62.89 -49.19 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 120.984 -1.073 . . . . 0.16 108.391 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.443 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.5 t-20 -59.86 -36.62 77.25 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.84 -1.17 . . . . 0.95 107.84 179.002 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -67.17 -39.54 86.47 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.62 -0.675 . . . . 2.21 109.718 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.588 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.4 mt -100.82 0.57 38.91 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.839 -1.163 . . . . 0.25 111.683 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 102' ' ' ASN . 7.9 p . . . . . 0 N--CA 1.497 1.892 0 O-C-N 120.191 -1.568 . . . . 1.08 109.395 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 N--CA 1.491 1.346 0 CA-C-O 120.912 0.297 . . . . 1.46 112.632 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -92.24 119.59 31.99 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.867 -1.146 . . . . 0.88 109.965 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.487 HG22 ' H ' ' B' ' 63' ' ' LYS . 28.6 m -115.68 130.03 56.7 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.898 -0.778 . . . . 0.7 108.898 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.61 -30.67 71.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.61 109.74 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.487 ' H ' HG22 ' B' ' 61' ' ' THR . 71.2 mmtt -62.49 -23.64 67.04 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.286 -0.884 . . . . 1.31 110.331 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.523 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 31.2 mm -130.51 142.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 N-CA-C 109.728 -0.471 . . . . 0.15 109.728 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.4 m -97.69 129.55 44.74 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.635 -1.617 . . . . 0.19 106.635 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -79.53 139.86 37.42 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.894 -1.129 . . . . 0.2 111.307 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' B' ' 69' ' ' VAL . 24.0 m95 -74.42 -11.51 60.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.674 -0.641 . . . . 0.21 109.273 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 30.7 m-20 -49.24 -13.16 0.06 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.399 -0.813 . . . . 0.49 109.033 179.479 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.505 ' N ' ' O ' ' B' ' 67' ' ' TRP . 15.9 m -63.43 146.1 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 N-CA-C 108.373 -0.973 . . . . 1.04 108.373 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -59.13 -40.43 85.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.763 -1.211 . . . . 1.36 109.345 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.077 0 CA-C-O 117.929 -1.484 . . . . 2.32 109.468 -179.993 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptp . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.356 0.598 . . . . 2.88 110.005 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.452 HG12 ' N ' ' A' ' 3' ' ' LYS . 98.9 t -99.43 158.6 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.285 -0.884 . . . . 0.45 109.868 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.452 ' N ' HG12 ' A' ' 2' ' ' VAL . 43.9 tptt -130.06 129.56 43.78 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 108.546 -0.909 . . . . 1.67 108.546 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -96.45 124.01 40.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.201 -0.937 . . . . 0.31 108.653 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.2 mm -100.73 113.78 37.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 N-CA-C 108.364 -0.976 . . . . 0.19 108.364 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.74 -3.7 32.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.278 -0.889 . . . . 2.25 109.321 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -152.49 155.9 38.37 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.22 -0.925 . . . . 0.15 110.612 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -64.59 -31.84 73.23 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.349 -0.982 . . . . 1.65 108.349 178.642 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.7 m -55.64 -47.87 75.91 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.416 -0.913 . . . . 0.23 109.018 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.08 -30.24 69.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.427 -0.796 . . . . 0.17 109.177 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.512 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.6 t80 -59.69 -45.23 92.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.189 -0.944 . . . . 0.14 109.237 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -63.87 -41.41 97.76 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 108.89 -0.781 . . . . 1.31 108.89 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.98 -37.21 86.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.677 -0.639 . . . . 1.77 110.006 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.45 80.32 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.369 -0.832 . . . . 0.15 109.42 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.512 HD11 ' CE2' ' A' ' 11' ' ' PHE . 85.1 mt -60.21 -40.12 88.99 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.444 -0.947 . . . . 0.17 108.444 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.83 -34.77 74.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.625 -0.672 . . . . 1.07 109.925 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.7 85.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.283 -0.886 . . . . 0.18 109.91 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.47 -31.87 71.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.246 -0.909 . . . . 0.17 109.999 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.49 18.38 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.687 -1.365 . . . . 0.2 109.687 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -91.77 2.52 56.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -1.102 . . . . 1.07 110.374 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -76.02 149.16 37.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.98 -1.075 . . . . 1.5 109.593 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.666 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.84 159.57 8.81 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.487 -1.301 . . . . 0.47 107.487 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.666 ' H ' HD23 ' A' ' 22' ' ' LEU . 96.1 t -146.9 109.94 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 O-C-N 120.823 -1.173 . . . . 0.17 108.82 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.7 t -98.27 142.27 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 N-CA-C 107.971 -1.122 . . . . 0.14 107.971 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.96 121.0 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.455 -0.778 . . . . 0.13 109.488 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.552 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.9 t70 -98.67 119.74 37.92 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.395 -0.816 . . . . 1.05 110.404 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -96.18 21.67 8.61 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.456 -0.777 . . . . 0.73 109.743 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -57.29 145.01 33.47 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.978 -1.076 . . . . 0.3 109.945 -178.476 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.562 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.9 127.43 33.5 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.678 -1.23 . . . . 0.22 107.678 179.155 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -68.59 -31.7 71.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.827 -1.149 . . . . 0.3 108.822 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.562 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.6 p-90 -73.22 -20.81 60.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.066 -1.021 . . . . 0.26 110.838 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 21.6 t -81.88 122.64 28.0 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.834 -1.166 . . . . 0.26 108.54 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.491 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.42 -54.04 34.86 Favored Glycine 0 N--CA 1.489 2.175 0 C-N-CA 120.748 -0.739 . . . . 0.23 111.822 -178.439 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.2 Cg_endo -60.56 -30.0 89.71 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 CA-C-N 119.398 1.599 . . . . 0.31 112.533 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -77.39 -54.19 6.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.072 -1.017 . . . . 0.24 109.695 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -61.35 -38.15 85.91 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.305 -0.872 . . . . 1.59 109.673 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.44 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 35.5 ttm -59.88 -28.17 67.31 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.46 -0.775 . . . . 2.1 109.529 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 38' ' ' ILE . 66.4 mt -80.94 -4.41 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.847 -0.533 . . . . 0.49 110.735 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.546 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.2 ptmt -64.36 -26.07 1.79 Allowed Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 120.364 -1.46 . . . . 0.8 113.174 -178.081 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.546 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.5 Cg_exo -57.42 -40.29 82.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 122.468 1.917 . . . . 0.28 112.663 -177.1 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -67.9 -46.16 72.38 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 118.204 -1.398 . . . . 0.37 108.196 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -60.18 -53.9 52.23 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.125 -0.985 . . . . 0.16 109.884 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.404 ' ND1' HG21 ' A' ' 2' ' ' VAL . 38.0 t60 -68.09 -40.17 82.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.595 -0.691 . . . . 0.32 111.391 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.51 -39.16 92.62 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.855 -1.153 . . . . 0.22 110.643 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.86 -21.91 65.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.183 -0.948 . . . . 0.22 110.368 -178.554 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.3 m -53.51 -34.95 59.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.854 -1.154 . . . . 0.16 108.478 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 44.8 mp0 -88.75 -14.9 36.05 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.486 -0.759 . . . . 2.16 109.123 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.13 -37.79 37.71 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.708 -1.219 . . . . 1.78 107.708 178.874 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -123.13 68.87 0.99 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 106.861 -1.533 . . . . 0.25 106.861 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.8 p -63.38 -8.53 9.13 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.932 -0.766 . . . . 0.22 108.932 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -90.98 8.94 32.74 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.275 -0.891 . . . . 1.13 108.62 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.448 HG13 ' HB3' ' A' ' 22' ' ' LEU . 42.8 t -127.29 144.97 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.685 -1.228 . . . . 0.24 107.685 178.849 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -99.82 123.65 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.009 -1.057 . . . . 0.15 109.473 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.546 ' C ' HD12 ' A' ' 55' ' ' LEU . 44.3 m-85 -104.81 125.25 50.67 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.424 -0.798 . . . . 0.12 109.7 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.546 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.7 mp -110.0 142.7 41.03 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.121 -0.987 . . . . 0.22 109.196 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -109.95 131.7 54.82 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.908 -1.516 . . . . 1.13 106.908 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.0 t -128.28 137.76 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.325 -0.859 . . . . 0.15 110.6 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.0 t0 -100.17 119.0 37.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 1.05 108.905 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -67.96 -17.54 22.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 120.394 -1.441 . . . . 0.16 108.149 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.513 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.3 m-20 -90.01 -42.72 10.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 1.08 111.458 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -97.66 -22.15 16.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.651 -1.28 . . . . 1.07 109.276 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -115.96 38.39 3.35 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.146 -1.427 . . . . 0.14 107.146 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.55 ' CD ' ' H ' ' A' ' 63' ' ' GLN . 0.0 OUTLIER -60.34 -20.49 59.54 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.814 -0.63 . . . . 1.47 109.65 -179.121 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.624 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -63.76 -37.92 89.19 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.959 -1.088 . . . . 1.05 108.933 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.624 HG23 ' OD1' ' A' ' 64' ' ' ASP . 14.8 t -74.38 -43.55 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.327 -0.858 . . . . 0.35 109.532 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.26 -39.64 78.31 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.491 -0.755 . . . . 0.26 111.005 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.9 p -62.64 -35.68 80.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.915 -1.116 . . . . 0.24 109.166 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.6 -38.45 91.16 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.489 -0.757 . . . . 2.06 109.569 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.72 -0.19 56.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.282 -0.886 . . . . 0.23 111.285 -178.76 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 54.87 50.31 15.91 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.866 -1.146 . . . . 2.02 110.42 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.9 t -65.66 132.24 31.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 120.941 -1.1 . . . . 0.16 109.114 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -103.83 -11.94 17.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.601 -0.687 . . . . 1.6 110.693 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.504 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -163.9 155.27 16.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.81 -1.181 . . . . 0.14 110.348 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -126.74 155.92 74.41 Favored Pre-proline 0 N--CA 1.498 1.959 0 N-CA-C 107.6 -1.259 . . . . 0.15 107.6 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -75.99 143.91 78.14 Favored 'Cis proline' 0 N--CA 1.487 1.098 0 C-N-CA 123.681 -1.383 . . . . 0.16 112.541 -1.709 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.82 133.79 48.13 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.517 -0.92 . . . . 0.13 108.517 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.552 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -113.33 131.47 55.95 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.538 -0.912 . . . . 0.2 108.538 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -122.54 141.62 51.48 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.273 -0.892 . . . . 0.29 108.684 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -107.8 132.64 53.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.697 -0.627 . . . . 0.14 110.582 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -125.28 147.39 49.13 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.368 0.604 . . . . 0.15 109.499 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -148.36 124.33 10.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.305 -0.872 . . . . 1.68 109.025 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.8 mttm 59.63 29.08 18.63 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.715 -1.217 . . . . 1.22 107.715 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.24 20.58 77.1 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.593 -1.403 . . . . 0.23 109.593 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 47.9 mm-40 -124.21 137.02 54.57 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.483 -1.01 . . . . 2.07 110.965 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.64 125.42 29.34 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.1 -1.0 . . . . 1.82 108.851 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 m -124.62 13.89 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.724 -0.61 . . . . 0.3 110.703 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.45 157.55 18.63 Favored Glycine 0 N--CA 1.499 2.88 0 C-N-CA 118.969 -1.586 . . . . 0.17 111.066 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.482 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.92 148.44 7.33 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.553 -0.906 . . . . 1.93 108.553 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.482 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 3.5 p90 -168.23 157.59 9.43 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.241 -0.912 . . . . 0.14 109.749 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -126.52 159.88 32.16 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.529 -0.732 . . . . 0.12 110.041 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.46 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.95 143.7 6.62 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.805 -1.318 . . . . 0.12 109.805 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.499 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.91 64.76 3.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.19 -1.182 . . . . 0.18 109.81 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.5 t-20 -117.42 94.25 4.48 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.015 -1.106 . . . . 0.88 108.015 178.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -31.44 71.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.04 -1.037 . . . . 1.06 111.129 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -65.3 -29.77 70.56 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.905 -1.122 . . . . 1.61 109.351 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -60.42 -34.31 73.78 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.916 -0.772 . . . . 1.45 108.916 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.67 -38.81 82.5 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.051 0.929 . . . . 0.19 108.74 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.2 -43.72 98.2 Favored 'General case' 0 C--N 1.292 -1.918 0 C-N-CA 119.785 -0.766 . . . . 2.1 110.909 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.78 -44.0 74.56 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 0.19 111.861 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.4 m -64.79 -40.06 94.62 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.741 -1.224 . . . . 0.2 109.64 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.6 mt -60.79 -49.58 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.339 -0.986 . . . . 0.16 108.339 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.483 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.6 t-20 -60.35 -35.18 75.08 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.99 0.9 . . . . 0.95 108.581 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.81 -39.58 87.75 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.864 -0.523 . . . . 2.21 109.6 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.662 ' HB2' HD11 ' A' ' 22' ' ' LEU . 82.5 mt -99.63 -2.86 34.47 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.197 -0.94 . . . . 0.25 111.631 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.483 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.496 1.842 0 O-C-N 120.545 -1.347 . . . . 1.08 109.515 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo . . . . . 0 N--CA 1.493 1.456 0 CA-C-O 121.297 0.457 . . . . 1.46 112.31 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -91.64 121.39 33.26 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.199 -0.938 . . . . 0.88 108.907 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.453 HG22 ' H ' ' B' ' 63' ' ' LYS . 23.7 m -106.91 129.88 54.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.308 -0.87 . . . . 0.7 109.371 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 90.5 mt -62.97 -29.89 71.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.472 -0.768 . . . . 0.61 109.756 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.453 ' H ' HG22 ' B' ' 61' ' ' THR . 45.3 mmtm -60.03 -19.68 53.99 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.815 -0.809 . . . . 1.31 108.815 -179.302 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.504 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 28.5 mm -131.5 140.0 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 O-C-N 121.864 -0.522 . . . . 0.15 109.732 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.0 m -96.4 128.44 43.33 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.156 -1.424 . . . . 0.19 107.156 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 55.2 m -77.61 141.6 39.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.723 -1.235 . . . . 0.2 110.751 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.459 ' C ' ' H ' ' B' ' 69' ' ' VAL . 25.7 m95 -76.94 -11.83 59.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.439 -0.788 . . . . 0.21 108.912 178.89 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 35.6 m-20 -52.94 -11.09 0.2 Allowed 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.586 -0.894 . . . . 0.49 108.586 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.459 ' H ' ' C ' ' B' ' 67' ' ' TRP . 15.6 m -61.8 140.45 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.639 -0.824 . . . . 1.04 109.133 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -60.15 -39.7 87.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.266 -0.896 . . . . 1.36 109.741 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.101 0 N-CA-C 108.927 -1.669 . . . . 2.32 108.927 -179.364 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 mmt . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.055 -0.721 . . . . 2.88 109.055 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.42 137.57 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.386 -0.821 . . . . 0.45 109.235 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -130.61 128.96 42.08 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.256 -0.902 . . . . 1.67 108.874 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -97.86 121.88 40.31 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.235 -1.024 . . . . 0.31 108.235 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.0 mm -99.99 112.89 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.19 108.743 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.04 -0.03 47.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 2.25 109.903 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -153.53 156.39 37.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.707 -1.246 . . . . 0.15 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -65.06 -33.0 74.99 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.318 -0.993 . . . . 1.65 108.318 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 90.0 m -56.14 -48.05 76.99 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.871 -0.788 . . . . 0.23 108.871 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.67 -29.69 66.08 Favored 'General case' 0 C--N 1.295 -1.763 0 O-C-N 121.545 -0.722 . . . . 0.17 109.089 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.9 t80 -59.66 -44.09 93.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.188 -0.945 . . . . 0.14 109.164 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -65.92 -43.93 86.65 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.834 -0.802 . . . . 1.31 108.834 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -63.59 -36.31 83.38 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.465 0.65 . . . . 1.77 110.068 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.97 -43.84 78.08 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.349 -0.845 . . . . 0.15 109.439 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.535 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.6 mt -60.88 -40.14 91.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.441 -0.787 . . . . 0.17 109.321 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -69.48 -32.61 71.61 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.426 -0.796 . . . . 1.07 110.448 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.68 83.04 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.18 109.355 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.82 -36.11 80.18 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.511 -0.743 . . . . 0.17 109.625 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.48 -123.27 16.29 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.976 -1.249 . . . . 0.2 109.976 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -91.15 3.75 53.98 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.195 -1.18 . . . . 1.07 110.224 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -77.14 149.18 35.65 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.994 -1.066 . . . . 1.5 109.768 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.694 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.3 153.72 21.88 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.834 -1.173 . . . . 0.47 107.834 -179.798 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.694 ' H ' HD23 ' A' ' 22' ' ' LEU . 57.3 t -143.97 120.73 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 N-CA-C 107.995 -1.113 . . . . 0.17 107.995 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -108.03 140.08 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.456 -0.942 . . . . 0.14 108.456 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -123.25 119.9 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.327 -0.858 . . . . 0.13 109.462 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.568 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 25.6 t70 -97.37 108.96 21.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.496 -0.753 . . . . 1.05 110.8 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.98 103.03 15.73 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.268 -1.753 . . . . 0.73 106.268 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.4 m -130.07 150.05 51.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.016 -0.735 . . . . 0.3 109.016 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.625 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.61 120.97 29.46 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.455 -1.313 . . . . 0.22 107.455 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -65.73 -32.21 73.63 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 118.541 -1.264 . . . . 0.3 108.039 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.625 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.3 p-90 -70.73 -23.77 62.51 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.32 -0.863 . . . . 0.26 111.063 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -84.43 115.13 22.38 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.827 -1.171 . . . . 0.26 108.751 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.454 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.72 -50.75 64.3 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 120.819 -0.705 . . . . 0.23 111.787 -178.272 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.2 Cg_exo -51.97 -36.18 63.55 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 CA-C-N 118.826 1.313 . . . . 0.31 112.866 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.5 -47.83 21.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.128 -0.982 . . . . 0.24 109.623 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.28 -35.68 76.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 1.59 109.097 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.54 ' SD ' ' O ' ' A' ' 37' ' ' MET . 11.6 tmm? -59.64 -29.36 67.98 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.516 -0.74 . . . . 2.1 110.06 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.539 HG22 ' O ' ' A' ' 38' ' ' ILE . 71.0 mt -82.71 -1.32 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.539 -0.726 . . . . 0.49 110.822 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.538 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.96 -30.12 6.43 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 120.535 -1.353 . . . . 0.8 113.976 -178.832 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.38 -40.6 66.08 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 CA-C-N 121.618 1.614 . . . . 0.28 113.266 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -68.8 -49.66 56.73 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 118.365 -1.334 . . . . 0.37 109.303 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.33 -51.08 71.06 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 121.761 0.791 . . . . 0.16 109.34 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.7 t60 -66.73 -40.96 88.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.621 -0.674 . . . . 0.32 110.724 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.422 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 72.3 m -63.39 -39.02 93.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.903 -1.123 . . . . 0.22 110.498 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.34 -23.08 66.57 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 0.22 111.366 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.4 m -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.788 -1.195 . . . . 0.16 108.364 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -88.94 -15.56 33.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.273 -0.892 . . . . 2.16 109.355 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HD3' ' CE2' ' A' ' 49' ' ' TYR . 13.2 tmtt? -79.26 -33.81 43.17 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.151 -1.425 . . . . 1.78 107.151 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.411 ' CE2' ' HD3' ' A' ' 48' ' ' LYS . 71.3 m-85 -122.16 64.43 0.93 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 106.776 -1.564 . . . . 0.25 106.776 177.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.5 p -61.86 -9.29 6.4 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.74 -0.837 . . . . 0.22 108.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -91.1 8.63 34.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.506 -0.746 . . . . 1.13 109.207 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.0 t -128.24 152.72 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 N-CA-C 108.225 -1.028 . . . . 0.24 108.225 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -102.73 122.12 54.69 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.148 -0.97 . . . . 0.15 110.132 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.589 ' C ' HD12 ' A' ' 55' ' ' LEU . 54.0 m-85 -105.49 130.05 53.65 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.238 -0.914 . . . . 0.12 109.868 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.589 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.4 mp -114.29 143.14 45.36 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.307 -0.871 . . . . 0.22 109.495 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -113.66 131.08 56.28 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 106.954 -1.499 . . . . 1.13 106.954 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.4 t -128.43 136.46 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 O-C-N 121.215 -0.928 . . . . 0.15 111.344 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.4 t0 -99.49 120.01 38.94 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.932 -0.766 . . . . 1.05 108.932 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.7 m -68.25 -16.7 21.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 O-C-N 120.523 -1.361 . . . . 0.16 108.471 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.6 m-20 -94.47 -40.76 9.72 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.426 -0.796 . . . . 1.08 111.448 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.5 m-20 -96.84 -16.79 20.59 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.796 -1.19 . . . . 1.07 108.62 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.61 40.67 3.67 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.489 -1.3 . . . . 0.14 107.489 179.0 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.09 -20.31 57.51 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.879 -0.513 . . . . 1.47 110.206 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.644 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.7 p30 -65.56 -38.65 90.17 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.683 -1.26 . . . . 1.05 109.176 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.644 HG23 ' OD1' ' A' ' 64' ' ' ASP . 20.1 t -72.76 -42.57 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.199 -0.938 . . . . 0.35 109.459 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.71 -41.95 71.25 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.484 -0.76 . . . . 0.26 110.999 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.7 p -60.14 -36.08 76.72 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.869 -1.144 . . . . 0.24 108.533 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -64.41 -39.28 93.54 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.475 -0.766 . . . . 2.06 109.492 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.56 0.45 54.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.25 -0.906 . . . . 0.23 111.019 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 54.14 50.07 17.33 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.917 -1.115 . . . . 2.02 110.059 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -65.58 131.69 31.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.787 -1.196 . . . . 0.16 109.043 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -103.71 -14.36 16.13 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.717 -0.614 . . . . 1.6 109.937 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.461 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.6 152.33 15.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.938 -1.101 . . . . 0.14 110.769 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.407 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.4 p -127.49 154.4 77.44 Favored Pre-proline 0 N--CA 1.503 2.176 0 N-CA-C 107.736 -1.209 . . . . 0.15 107.736 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -76.22 141.19 69.57 Favored 'Cis proline' 0 N--CA 1.495 1.59 0 C-N-CA 124.147 -1.189 . . . . 0.16 112.991 -1.889 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.2 m -126.72 139.2 53.32 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.498 -0.927 . . . . 0.13 108.498 177.845 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.568 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.8 m-85 -112.61 131.8 55.45 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.349 -0.982 . . . . 0.2 108.349 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.98 139.9 53.59 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.432 -0.951 . . . . 0.29 108.432 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -107.68 129.6 55.0 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.542 0.687 . . . . 0.14 110.034 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -122.58 143.27 49.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.753 -0.832 . . . . 0.15 108.753 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -146.28 130.61 17.61 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.426 -1.694 . . . . 1.68 106.426 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.2 mttt 58.17 27.75 15.52 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 108.449 -0.945 . . . . 1.22 108.449 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.3 17.26 80.1 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.893 -1.283 . . . . 0.23 109.893 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 39.4 mm-40 -123.33 138.48 54.6 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.449 -1.03 . . . . 2.07 111.107 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -79.58 124.44 28.53 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.352 -0.842 . . . . 1.82 109.347 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.2 m -121.53 6.81 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.529 -0.732 . . . . 0.3 110.648 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.34 155.56 15.31 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 118.666 -1.731 . . . . 0.17 111.321 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -164.25 149.89 10.61 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.812 -0.816 . . . . 1.93 109.546 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.407 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 17.8 p90 -163.01 161.81 25.65 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.92 -1.112 . . . . 0.14 109.151 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -127.0 162.38 26.14 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.485 0.66 . . . . 0.12 110.276 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.494 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 118.27 141.66 6.78 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.465 -1.454 . . . . 0.12 109.465 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.01 64.88 1.97 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.34 -1.094 . . . . 0.18 109.795 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.2 t-20 -117.47 95.9 5.17 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.558 -0.904 . . . . 0.88 108.558 178.796 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -34.1 73.15 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.248 -0.908 . . . . 1.06 111.212 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.24 -30.1 70.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.806 -1.184 . . . . 1.61 108.783 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -61.98 -34.43 76.14 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.746 -0.596 . . . . 1.45 109.404 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.417 HD21 ' CD1' ' A' ' 77' ' ' PHE . 50.8 mt -59.87 -39.93 86.93 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.13 0.967 . . . . 0.19 108.888 179.477 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -61.65 -43.64 98.48 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.581 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.29 -44.09 76.25 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.282 -0.886 . . . . 0.19 111.629 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.4 -40.02 92.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.733 -1.229 . . . . 0.2 109.659 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.6 mt -60.94 -49.48 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.206 -1.035 . . . . 0.16 108.206 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.465 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.5 t-20 -60.12 -34.78 73.98 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.48 -0.933 . . . . 0.95 108.48 179.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -67.91 -40.05 83.48 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.688 -0.632 . . . . 2.21 110.325 -178.643 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.643 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.9 mt -98.77 -3.68 35.09 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.148 -0.97 . . . . 0.25 111.117 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.492 1.631 0 O-C-N 120.548 -1.345 . . . . 1.08 109.076 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo . . . . . 0 N--CA 1.494 1.536 0 CA-C-O 121.366 0.486 . . . . 1.46 111.632 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.77 122.59 46.03 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 108.699 -0.852 . . . . 0.88 108.699 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.446 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.9 m -103.31 128.08 50.47 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.424 -0.797 . . . . 0.7 109.301 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.1 mt -69.6 -26.53 64.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.365 -0.834 . . . . 0.61 109.401 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.446 ' H ' HG22 ' B' ' 61' ' ' THR . 63.4 mmtt -60.6 -19.68 58.45 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.626 -0.671 . . . . 1.31 109.416 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.494 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.7 mm -129.17 140.07 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.622 -0.674 . . . . 0.15 109.967 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 63.3 m -96.75 124.35 40.71 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.163 -1.421 . . . . 0.19 107.163 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -77.61 141.57 39.41 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.845 -1.159 . . . . 0.2 110.908 -178.608 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.446 ' C ' ' N ' ' B' ' 69' ' ' VAL . 20.2 m95 -76.56 -10.01 59.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.005 -1.059 . . . . 0.21 108.508 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 44.1 m-20 -53.43 -11.76 0.36 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.577 -0.897 . . . . 0.49 108.577 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.446 ' N ' ' C ' ' B' ' 67' ' ' TRP . 16.5 m -61.32 144.46 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.38 -0.825 . . . . 1.04 109.114 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -59.03 -40.03 83.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.16 -0.962 . . . . 1.36 109.247 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 109.446 -1.461 . . . . 2.32 109.446 179.931 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.492 1.67 0 N-CA-C 109.306 -0.627 . . . . 2.88 109.306 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 93.5 t -99.2 131.6 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.205 -0.934 . . . . 0.45 108.605 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.8 tptt -130.02 129.18 43.37 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.269 -1.011 . . . . 1.67 108.269 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -98.01 123.7 42.14 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.331 -0.989 . . . . 0.31 108.331 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.0 mm -101.56 112.79 35.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.186 -0.946 . . . . 0.19 108.508 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.444 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 50.4 mp0 -95.87 -1.26 49.78 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.313 -0.867 . . . . 2.25 109.392 -179.057 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -153.98 154.8 34.41 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.947 -1.096 . . . . 0.15 111.439 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.9 ttpp -63.38 -31.16 72.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.98 -1.119 . . . . 1.65 107.98 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.8 m -59.05 -46.65 87.7 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.934 -0.765 . . . . 0.23 108.934 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 -30.02 66.4 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.288 -0.883 . . . . 0.17 108.692 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.58 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.6 t80 -59.45 -43.83 93.08 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.119 -0.988 . . . . 0.14 109.321 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -63.68 -41.98 98.09 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 119.634 -0.827 . . . . 1.31 108.796 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -64.94 -39.87 94.17 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.666 -0.646 . . . . 1.77 110.483 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -41.24 94.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.308 -0.87 . . . . 0.15 108.966 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.58 HD11 ' CE2' ' A' ' 11' ' ' PHE . 39.6 mt -61.23 -40.17 93.01 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.112 -0.993 . . . . 0.17 108.734 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.28 -34.55 72.91 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.965 -0.694 . . . . 1.07 109.698 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.03 80.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.362 -0.836 . . . . 0.18 110.298 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.23 70.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.069 -1.02 . . . . 0.17 109.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.81 -124.57 21.07 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.144 -1.582 . . . . 0.2 109.144 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -91.97 0.46 57.47 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -1.085 . . . . 1.07 110.336 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -75.72 149.89 37.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.996 -1.065 . . . . 1.5 109.345 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 22' ' ' LEU . 11.1 mt -55.81 160.58 2.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.019 -1.051 . . . . 0.47 110.213 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.1 t -148.62 108.35 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 107.995 -1.113 . . . . 0.17 107.995 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.3 t -100.95 140.8 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 107.606 -1.257 . . . . 0.14 107.606 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -124.63 124.5 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.186 -0.946 . . . . 0.13 109.748 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -101.09 116.96 34.05 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.431 -0.793 . . . . 1.05 110.022 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -91.95 22.53 4.22 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.73 110.265 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -54.52 144.42 21.38 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.666 -1.271 . . . . 0.3 110.667 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.693 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -80.99 127.97 33.17 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.084 -1.45 . . . . 0.22 107.084 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -67.94 -31.32 70.99 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.832 -1.147 . . . . 0.3 108.527 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.693 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 69.7 p-90 -76.53 -13.53 60.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.342 -0.849 . . . . 0.26 111.467 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.3 t -87.98 114.27 24.44 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.679 -1.263 . . . . 0.26 108.592 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.25 -51.94 54.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.647 -0.981 . . . . 0.23 110.647 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 32.9 Cg_exo -50.44 -38.04 52.65 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 CA-C-N 118.463 1.132 . . . . 0.31 112.183 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.99 -43.74 23.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.24 109.66 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -59.96 -32.13 70.53 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.986 -1.071 . . . . 1.59 108.819 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 54.5 ttm -60.41 -29.28 68.87 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 2.1 109.828 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.429 HD11 ' HB1' ' A' ' 92' ' ' ALA . 17.1 mt -80.29 -4.21 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.934 -0.479 . . . . 0.49 110.997 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.69 -30.93 7.11 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 119.823 -1.798 . . . . 0.8 113.724 -177.727 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.3 Cg_exo -59.5 -36.42 93.33 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 CA-C-N 121.586 1.602 . . . . 0.28 112.0 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -72.41 -51.63 19.52 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 118.686 -1.206 . . . . 0.37 108.874 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -59.61 -48.28 82.27 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.892 -0.781 . . . . 0.16 108.892 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -68.18 -42.46 79.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.298 -0.876 . . . . 0.32 110.812 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.3 m -64.52 -37.09 86.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.927 -1.108 . . . . 0.22 110.771 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.8 -22.78 66.87 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.125 -0.984 . . . . 0.22 110.525 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -53.57 -37.14 62.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.766 -1.209 . . . . 0.16 107.903 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -87.85 -15.34 37.05 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.556 -0.715 . . . . 2.16 109.501 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -76.69 -38.26 54.73 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.254 -1.387 . . . . 1.78 107.254 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -123.66 69.37 1.04 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.183 -1.414 . . . . 0.25 107.183 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.3 p -64.18 -8.98 14.17 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.012 -0.736 . . . . 0.22 109.012 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -89.07 8.54 29.3 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.621 -0.881 . . . . 1.13 108.621 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.36 146.46 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.059 -1.089 . . . . 0.24 108.059 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.1 mm -99.79 119.75 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 120.997 -1.064 . . . . 0.15 109.828 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.576 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.3 m-85 -101.15 127.85 47.52 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.273 -0.892 . . . . 0.12 109.98 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.7 mp -110.75 143.0 41.95 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.229 -0.919 . . . . 0.22 110.13 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -113.53 129.66 56.51 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 106.973 -1.492 . . . . 1.13 106.973 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.5 t -127.97 132.0 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.152 -0.968 . . . . 0.15 110.914 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 52.2 t0 -93.74 119.88 33.29 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.815 -0.809 . . . . 1.05 108.815 179.132 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.19 -17.33 22.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 120.672 -1.267 . . . . 0.16 107.797 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.503 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.18 -43.97 9.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 1.08 111.527 -178.924 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -94.41 -14.99 24.7 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.649 -1.282 . . . . 1.07 108.573 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.02 37.62 4.37 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.966 -1.124 . . . . 0.14 107.966 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.57 -18.14 38.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.8 -0.563 . . . . 1.47 110.668 -178.398 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 1.3 p30 -66.36 -43.08 87.02 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.838 -1.164 . . . . 1.05 108.719 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.2 t -68.72 -44.62 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.469 -0.769 . . . . 0.35 110.056 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.25 -39.08 75.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.426 -0.796 . . . . 0.26 110.663 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -62.62 -32.79 73.87 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.942 -1.099 . . . . 0.24 109.154 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.05 -39.86 95.02 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.494 -0.754 . . . . 2.06 109.617 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.33 2.03 51.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -0.932 . . . . 0.23 110.476 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 53.14 51.55 15.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.322 -0.861 . . . . 2.02 108.788 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.5 t -63.97 131.14 29.55 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 C-N-CA 118.517 -1.273 . . . . 0.16 108.391 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -103.77 -11.38 17.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.679 -0.638 . . . . 1.6 110.707 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.7 154.87 18.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.709 -1.245 . . . . 0.14 111.167 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.494 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.4 p -126.34 154.53 74.77 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.359 -0.978 . . . . 0.15 108.359 178.93 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.35 143.69 75.54 Favored 'Cis proline' 0 N--CA 1.494 1.518 0 C-N-CA 123.829 -1.321 . . . . 0.16 112.615 -2.867 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 86.0 m -129.66 131.19 46.32 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.556 0.693 . . . . 0.13 109.305 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -108.59 132.76 53.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.6 -0.687 . . . . 0.2 109.221 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -122.72 141.07 52.18 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.506 -0.924 . . . . 0.29 108.506 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -108.51 133.9 52.03 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.741 -0.599 . . . . 0.14 110.167 -179.2 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -124.56 147.26 48.54 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.502 0.668 . . . . 0.15 109.837 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -144.99 128.58 17.1 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.87 -1.159 . . . . 1.68 107.87 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 49.69 38.78 16.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.116 -0.99 . . . . 1.22 108.335 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.73 24.29 76.38 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.796 -1.192 . . . . 0.23 110.169 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 41.4 mm-40 -128.37 135.12 49.11 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.333 -1.098 . . . . 2.07 110.339 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -79.46 127.38 32.05 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.035 -1.04 . . . . 1.82 109.312 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.9 m -124.19 5.59 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.71 -0.619 . . . . 0.3 110.692 -179.653 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.82 154.22 13.89 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 118.465 -1.826 . . . . 0.17 111.476 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.7 tm-20 -164.88 149.71 9.39 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.788 -0.83 . . . . 1.93 109.305 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.439 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 15.1 p90 -163.18 160.97 24.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.192 -1.003 . . . . 0.14 109.524 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.73 159.99 30.9 Favored 'General case' 0 N--CA 1.5 2.053 0 CA-C-O 121.388 0.614 . . . . 0.12 109.71 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.463 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.88 142.14 6.09 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 108.933 -1.667 . . . . 0.12 108.933 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.429 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.09 66.01 4.42 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.217 -1.167 . . . . 0.18 109.94 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.6 t-20 -119.64 99.89 6.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.351 -0.843 . . . . 0.88 109.306 178.647 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.413 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.47 -33.51 74.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.341 -0.849 . . . . 1.06 111.672 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.22 -27.13 67.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.438 -1.414 . . . . 1.61 109.376 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 22.5 ttmt -61.13 -37.75 83.93 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.144 -1.058 . . . . 1.45 108.144 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.5 mt -58.63 -39.6 80.99 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 122.056 0.931 . . . . 0.19 108.5 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -61.53 -43.22 99.25 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.21 -0.596 . . . . 2.1 111.005 -178.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.53 -43.99 71.9 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.094 -1.004 . . . . 0.19 112.08 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.99 -39.23 93.16 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.798 -1.189 . . . . 0.2 110.172 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.98 -49.57 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.097 -1.002 . . . . 0.16 108.377 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.8 t-20 -60.91 -35.76 77.52 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.589 -0.893 . . . . 0.95 108.589 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.5 tm-20 -68.25 -39.1 82.35 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.695 -0.628 . . . . 2.21 110.166 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.91 -6.5 28.77 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.002 -1.061 . . . . 0.25 111.534 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' ' 105' ' ' VAL . 7.9 p . . . . . 0 N--CA 1.501 2.101 0 O-C-N 120.441 -1.412 . . . . 1.08 109.657 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.496 1.657 0 CA-C-O 121.206 0.419 . . . . 1.46 112.377 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.2 124.98 39.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.199 -0.938 . . . . 0.88 108.84 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.456 ' O ' ' O ' ' B' ' 64' ' ' ILE . 21.3 m -107.33 129.98 54.83 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.347 -0.845 . . . . 0.7 109.18 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.77 -29.21 68.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.276 -0.89 . . . . 0.61 109.018 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.456 ' H ' HG22 ' B' ' 61' ' ' THR . 67.2 mmtt -64.4 -19.59 65.6 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.352 -0.843 . . . . 1.31 108.765 -179.328 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.463 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.4 mm -130.07 140.32 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.794 -0.566 . . . . 0.15 109.571 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -99.83 129.83 45.97 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 106.759 -1.571 . . . . 0.19 106.759 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.1 m -81.46 138.4 35.52 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.535 -1.353 . . . . 0.2 111.321 -178.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.494 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.2 m95 -72.11 -9.79 58.9 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.064 -1.022 . . . . 0.21 109.572 178.845 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -52.91 -12.32 0.31 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.49 109.272 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.496 HG11 ' CH2' ' A' ' 31' ' ' TRP . 10.8 m -57.68 139.31 17.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 O-C-N 121.319 -0.863 . . . . 1.04 109.264 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -59.77 -39.17 83.94 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 120.874 -1.141 . . . . 1.36 109.529 -179.466 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 CA-C-O 118.18 -1.345 . . . . 2.32 110.248 -179.581 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.5 tpt . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.178 -0.675 . . . . 2.88 109.178 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.46 HG12 ' N ' ' A' ' 3' ' ' LYS . 95.6 t -98.71 159.22 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.464 -0.773 . . . . 0.45 109.465 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.46 ' N ' HG12 ' A' ' 2' ' ' VAL . 80.2 tttt -129.88 124.44 33.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.414 -0.804 . . . . 1.67 108.885 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -94.3 124.12 38.12 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.359 -0.978 . . . . 0.31 108.359 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -100.16 112.85 33.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 108.478 -0.934 . . . . 0.19 108.478 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.454 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -97.39 -0.26 46.61 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.063 -1.023 . . . . 2.25 109.652 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -155.16 159.15 39.94 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.993 -1.067 . . . . 0.15 111.216 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -63.5 -32.34 73.76 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.073 -1.084 . . . . 1.65 108.073 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.432 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 88.1 m -57.76 -48.35 79.9 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.665 -0.814 . . . . 0.23 108.813 -179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -30.86 69.45 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.259 -0.901 . . . . 0.17 108.715 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.1 t80 -59.33 -43.87 92.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.149 -0.969 . . . . 0.14 109.06 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -66.35 -42.99 87.27 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 120.046 -0.662 . . . . 1.31 109.449 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -65.12 -39.94 93.79 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.69 -0.631 . . . . 1.77 110.328 179.629 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.73 88.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.081 -1.012 . . . . 0.15 109.446 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.539 HD11 ' CE2' ' A' ' 11' ' ' PHE . 63.8 mt -60.71 -39.94 90.42 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.162 -1.051 . . . . 0.17 108.162 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -69.84 -36.96 75.99 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.674 -0.641 . . . . 1.07 110.205 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.76 -37.48 82.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.51 -0.744 . . . . 0.18 109.926 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.07 72.93 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.871 . . . . 0.17 109.649 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -125.87 24.67 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 110.015 -1.234 . . . . 0.2 110.015 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -92.02 5.9 48.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.107 -1.231 . . . . 1.07 110.203 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -76.39 149.36 36.93 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.838 -1.164 . . . . 1.5 109.472 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.676 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.05 155.53 16.78 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.523 -1.288 . . . . 0.47 107.523 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.655 ' H ' HD23 ' A' ' 22' ' ' LEU . 64.7 t -143.22 111.54 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 O-C-N 120.919 -1.113 . . . . 0.17 109.059 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.0 t -100.65 141.88 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 107.91 -1.145 . . . . 0.14 107.91 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.06 124.31 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.341 -0.85 . . . . 0.13 109.443 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.5 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.637 -0.664 . . . . 1.05 110.144 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -95.91 23.17 6.58 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.348 -0.845 . . . . 0.73 109.95 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.415 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.5 m -59.02 145.25 42.58 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.844 -1.16 . . . . 0.3 110.385 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.582 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.05 126.81 33.42 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.547 -1.279 . . . . 0.22 107.547 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -68.27 -28.31 67.09 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 118.848 -1.141 . . . . 0.3 108.781 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.582 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.8 p-90 -77.42 -19.22 56.4 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.079 -1.013 . . . . 0.26 110.072 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 34.2 t -83.84 122.45 28.71 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.167 -1.049 . . . . 0.26 108.167 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.49 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.6 -54.08 34.11 Favored Glycine 0 N--CA 1.488 2.113 0 C-N-CA 120.728 -0.749 . . . . 0.23 111.977 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.3 Cg_endo -59.53 -31.04 93.93 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 CA-C-N 119.588 1.694 . . . . 0.31 112.404 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -76.69 -55.48 5.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.036 -1.04 . . . . 0.24 109.805 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -60.16 -38.43 83.15 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.942 -1.099 . . . . 1.59 110.25 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.33 -28.79 67.14 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.088 -1.008 . . . . 2.1 109.677 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.8 mt -83.36 -3.86 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.751 -0.593 . . . . 0.49 111.312 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.4 ptmt -66.67 -29.83 3.0 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 120.262 -1.524 . . . . 0.8 113.468 -177.372 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -54.74 -39.83 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.759 1.664 . . . . 0.28 112.409 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.434 ' CD2' ' HG3' ' A' ' 94' ' ' LYS . 32.4 m-85 -68.74 -44.05 74.61 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 118.187 -1.405 . . . . 0.37 108.134 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -60.34 -54.18 48.77 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.33 -0.856 . . . . 0.16 109.533 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.443 ' CE1' HG21 ' A' ' 2' ' ' VAL . 44.3 t60 -66.98 -39.92 87.29 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.82 -0.55 . . . . 0.32 110.554 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 75.7 m -61.47 -37.79 84.91 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.87 -1.144 . . . . 0.22 110.286 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.3 mt -60.99 -23.6 65.49 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.334 -0.854 . . . . 0.22 110.298 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -54.79 -38.94 67.91 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.069 -1.02 . . . . 0.16 108.915 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.8 mp0 -87.87 -13.51 41.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 2.16 109.733 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -80.34 -37.49 32.42 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 105.76 -1.941 . . . . 1.78 105.76 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -123.1 66.75 0.98 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.199 -1.408 . . . . 0.25 107.199 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.3 p -62.33 -8.32 5.73 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.952 -0.759 . . . . 0.22 108.952 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -91.03 9.72 29.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.737 -0.838 . . . . 1.13 108.737 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.469 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.5 t -129.3 147.01 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 N-CA-C 108.169 -1.048 . . . . 0.24 108.169 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.8 120.1 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 120.961 -1.087 . . . . 0.15 110.165 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.477 ' C ' HD12 ' A' ' 55' ' ' LEU . 29.3 m-85 -102.28 127.84 49.08 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.985 -1.072 . . . . 0.12 109.348 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.477 HD12 ' C ' ' A' ' 54' ' ' PHE . 1.9 mp -110.02 140.3 44.19 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.245 -0.909 . . . . 0.22 109.389 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -110.4 129.52 55.74 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.69 -1.596 . . . . 1.13 106.69 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.67 129.87 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 121.555 0.693 . . . . 0.15 110.252 -178.188 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 55.7 t0 -93.24 119.58 32.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.333 -0.988 . . . . 1.05 108.333 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -67.29 -20.46 26.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 C-N-CA 118.301 -1.36 . . . . 0.16 108.186 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.541 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.39 -42.12 10.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.433 -0.792 . . . . 1.08 111.696 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.441 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 22.0 m-20 -96.18 -13.86 23.2 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.688 -1.257 . . . . 1.07 108.412 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -126.06 40.05 3.81 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.703 -1.221 . . . . 0.14 107.703 179.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -59.86 -24.81 64.53 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.841 -0.537 . . . . 1.47 109.969 -178.618 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.608 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -65.52 -39.36 91.71 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.79 -1.194 . . . . 1.05 109.497 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.608 HG23 ' OD1' ' A' ' 64' ' ' ASP . 15.2 t -69.92 -44.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.133 -0.979 . . . . 0.35 109.669 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -36.52 66.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.681 -0.637 . . . . 0.26 110.847 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.8 p -60.55 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.24 109.573 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.3 -37.08 85.85 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.292 -0.88 . . . . 2.06 109.537 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.459 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.13 -0.15 53.59 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 0.23 111.04 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.2 mp0 54.38 49.41 18.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.984 -1.073 . . . . 2.02 109.845 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.85 134.35 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 120.833 -1.167 . . . . 0.16 108.763 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -106.43 -12.48 15.63 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.527 -0.733 . . . . 1.6 110.474 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.487 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -161.26 153.37 19.86 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.836 -1.165 . . . . 0.14 110.562 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -125.2 155.65 70.88 Favored Pre-proline 0 N--CA 1.499 2.016 0 N-CA-C 107.861 -1.163 . . . . 0.15 107.861 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -76.35 145.09 81.22 Favored 'Cis proline' 0 N--CA 1.491 1.341 0 C-N-CA 123.724 -1.365 . . . . 0.16 112.514 -2.459 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.7 m -129.45 132.2 46.91 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 108.735 -0.839 . . . . 0.13 108.735 178.443 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.729 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.0 m-85 -110.16 130.76 55.49 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 109.109 -0.7 . . . . 0.2 109.109 -179.191 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.459 HE22 ' HB1' ' A' ' 69' ' ' ALA . 72.2 mt-30 -122.82 139.34 54.12 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.739 -0.838 . . . . 0.29 108.739 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -106.83 132.06 53.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.356 0.598 . . . . 0.14 110.197 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -125.94 147.75 49.42 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.181 -0.674 . . . . 0.15 109.181 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -147.18 125.54 12.32 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.483 -1.303 . . . . 1.68 107.483 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.1 mttt 59.58 28.22 17.58 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.195 -1.409 . . . . 1.22 107.195 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.34 16.24 80.86 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.996 -1.242 . . . . 0.23 109.996 -179.395 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.6 mm100 -115.57 132.94 56.47 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.472 -1.016 . . . . 2.07 110.467 -179.718 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -77.14 124.22 27.5 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 107.896 -1.15 . . . . 1.82 107.896 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.8 m -123.52 11.88 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.696 -0.627 . . . . 0.3 110.06 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.23 156.03 15.08 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 118.909 -1.615 . . . . 0.17 111.251 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -166.4 148.0 6.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.886 -0.773 . . . . 1.93 109.223 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.573 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 7.1 p90 -164.47 159.04 18.99 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 119.828 -0.749 . . . . 0.14 109.523 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.67 161.39 28.19 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.558 0.694 . . . . 0.12 110.022 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.439 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.98 142.1 5.93 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.519 -1.433 . . . . 0.12 109.519 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.566 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.26 65.06 2.78 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -1.094 . . . . 0.18 109.721 -179.556 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -120.04 90.82 3.4 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.398 -0.964 . . . . 0.88 108.398 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.492 ' H ' ' CD ' ' A' ' 94' ' ' LYS . 0.2 OUTLIER -64.47 -35.13 79.95 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.068 -1.02 . . . . 1.06 111.546 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -62.04 -30.06 70.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.798 -1.189 . . . . 1.61 109.969 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.573 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 58.3 tttm -61.46 -32.91 72.91 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.669 0.747 . . . . 1.45 109.314 -179.183 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.729 HD21 ' CD1' ' A' ' 77' ' ' PHE . 47.0 mt -59.62 -39.68 85.04 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.215 -1.031 . . . . 0.19 108.215 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.47 -41.36 97.12 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 120.073 -0.651 . . . . 2.1 110.547 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.82 -43.45 75.54 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.087 -1.008 . . . . 0.19 111.698 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.8 m -67.3 -36.09 80.81 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.757 -1.214 . . . . 0.2 109.949 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.7 -50.11 79.34 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.061 -1.024 . . . . 0.16 108.35 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.476 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.3 t30 -60.03 -34.47 73.42 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.256 -1.016 . . . . 0.95 108.256 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.07 -39.97 82.82 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.752 -0.592 . . . . 2.21 110.406 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.676 ' HB2' HD11 ' A' ' 22' ' ' LEU . 94.8 mt -98.95 -2.99 36.07 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.218 -0.926 . . . . 0.25 111.293 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.2 p . . . . . 0 N--CA 1.496 1.87 0 O-C-N 120.413 -1.43 . . . . 1.08 109.11 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo . . . . . 0 N--CA 1.493 1.459 0 CA-C-O 120.899 0.291 . . . . 1.46 112.424 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.09 124.14 36.85 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.098 -1.001 . . . . 0.88 108.809 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.418 HG22 ' H ' ' B' ' 63' ' ' LYS . 28.5 m -100.07 129.88 46.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.29 -0.881 . . . . 0.7 109.749 -179.49 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 83.3 mt -68.15 -30.66 69.84 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.498 -0.751 . . . . 0.61 109.782 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.418 ' H ' HG22 ' B' ' 61' ' ' THR . 63.2 mmtt -61.17 -16.83 48.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.499 -0.751 . . . . 1.31 109.674 -179.001 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.487 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 32.7 mm -129.02 140.11 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 N-CA-C 109.259 -0.645 . . . . 0.15 109.259 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.0 m -98.29 131.55 44.52 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 107.272 -1.381 . . . . 0.19 107.272 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -81.46 140.12 34.8 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.614 -1.304 . . . . 0.2 111.29 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.456 ' C ' ' N ' ' B' ' 69' ' ' VAL . 25.1 m95 -74.22 -10.1 59.27 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.203 -0.936 . . . . 0.21 109.697 179.021 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 25.3 m-20 -52.0 -12.03 0.2 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.008 -1.057 . . . . 0.49 108.76 179.249 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.456 ' N ' ' C ' ' B' ' 67' ' ' TRP . 17.3 m -63.48 143.8 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 1.04 109.27 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.57 -37.92 79.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.159 -0.963 . . . . 1.36 109.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.027 0 N-CA-C 109.128 -1.589 . . . . 2.32 109.128 -179.418 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.413 ' SD ' ' OE2' ' A' ' 47' ' ' GLU . 36.0 mmt . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 108.689 -0.856 . . . . 2.88 108.689 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.5 t -99.82 136.5 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.24 -0.913 . . . . 0.45 109.515 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -129.89 126.31 37.64 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.122 -1.066 . . . . 1.67 108.122 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -97.13 123.24 40.84 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.339 -0.986 . . . . 0.31 108.339 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.0 mm -100.3 112.8 34.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.774 -0.824 . . . . 0.19 108.774 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.4 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -94.63 -2.01 52.15 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 120.916 -1.115 . . . . 2.25 110.203 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -152.21 154.08 35.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.659 -1.275 . . . . 0.15 110.801 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -63.45 -32.42 73.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.258 -1.016 . . . . 1.65 108.258 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.6 m -57.89 -46.73 84.48 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.285 -0.966 . . . . 0.23 108.651 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.12 -29.53 67.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.412 -0.805 . . . . 0.17 108.992 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.401 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.6 t80 -59.85 -44.09 94.31 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.479 -0.934 . . . . 0.14 108.479 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.32 -43.64 94.03 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.016 -0.735 . . . . 1.31 109.016 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -64.29 -35.8 82.03 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.376 0.608 . . . . 1.77 109.819 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.04 -41.67 81.7 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.271 -0.893 . . . . 0.15 109.045 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.6 mt -61.0 -41.22 96.09 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.104 -1.038 . . . . 0.17 108.668 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -69.5 -39.28 77.68 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.399 -0.813 . . . . 1.07 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.36 80.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.257 -0.902 . . . . 0.18 110.405 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.82 -28.62 69.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.162 -0.961 . . . . 0.17 110.257 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.02 -130.7 30.33 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.045 -1.222 . . . . 0.2 110.045 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -89.97 2.47 55.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.124 -1.221 . . . . 1.07 110.698 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -76.73 150.44 36.26 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.902 -1.124 . . . . 1.5 109.474 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' A' ' 22' ' ' LEU . 12.2 mt -57.97 158.64 6.42 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.106 -0.996 . . . . 0.47 111.011 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.1 t -147.06 108.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.432 -0.951 . . . . 0.17 108.432 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.401 HG22 ' CD2' ' A' ' 79' ' ' PHE . 58.7 t -101.48 143.53 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.227 -1.397 . . . . 0.14 107.227 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -125.18 123.24 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.319 -0.863 . . . . 0.13 110.139 -178.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.522 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.16 123.57 42.28 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.006 -0.738 . . . . 1.05 109.006 179.105 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.72 24.34 8.46 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.997 -1.065 . . . . 0.73 109.601 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.424 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 46.8 m -58.47 147.9 30.14 Favored 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.09 -1.006 . . . . 0.3 110.498 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.6 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.44 127.29 34.34 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 107.422 -1.325 . . . . 0.22 107.422 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.2 t -66.93 -30.92 71.19 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.695 -1.202 . . . . 0.3 108.949 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.6 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 64.0 p-90 -76.61 -16.48 59.56 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.09 -1.006 . . . . 0.26 111.565 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -86.38 114.0 22.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.616 -1.302 . . . . 0.26 108.408 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.45 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -59.98 -51.37 59.3 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 120.317 -0.944 . . . . 0.23 111.232 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 32.8 Cg_exo -50.44 -37.6 51.71 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 CA-C-N 118.96 1.38 . . . . 0.31 112.396 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.424 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.85 -44.17 28.08 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.272 -0.893 . . . . 0.24 109.331 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -59.85 -32.02 70.29 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.534 -0.913 . . . . 1.59 108.534 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.8 ttt -60.14 -29.3 68.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.582 -0.699 . . . . 2.1 109.797 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.492 HD11 ' HB1' ' A' ' 92' ' ' ALA . 8.6 mt -83.01 -4.65 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.512 -0.743 . . . . 0.49 110.833 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.535 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.18 -32.45 10.83 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 119.701 -1.874 . . . . 0.8 113.131 -176.986 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.7 Cg_exo -58.82 -36.53 96.86 Favored 'Trans proline' 0 N--CA 1.493 1.446 0 CA-C-N 121.675 1.634 . . . . 0.28 112.046 -178.226 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.41 -51.88 18.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.822 -1.174 . . . . 0.37 109.007 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.37 -46.85 87.5 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.155 0.979 . . . . 0.16 108.744 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -68.07 -46.88 69.82 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 115.918 -0.583 . . . . 0.32 110.866 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 72.8 m -60.88 -38.87 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.091 -1.005 . . . . 0.22 110.343 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.32 -24.52 66.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.263 -0.898 . . . . 0.22 111.07 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.4 m -54.1 -37.75 64.62 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.659 -1.275 . . . . 0.16 108.109 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE2' ' SD ' ' A' ' 1' ' ' MET . 73.0 mm-40 -85.44 -18.22 34.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.917 -1.114 . . . . 2.16 109.789 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -74.84 -37.03 62.35 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.052 -1.462 . . . . 1.78 107.052 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -122.99 68.07 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 107.243 -1.391 . . . . 0.25 107.243 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.6 p -64.7 -8.71 15.7 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.97 -0.752 . . . . 0.22 108.97 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -91.66 6.72 44.72 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 1.13 108.385 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.4 t -126.02 146.02 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 107.73 -1.211 . . . . 0.24 107.73 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.2 mm -99.1 124.88 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.132 -0.98 . . . . 0.15 109.73 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.53 ' C ' HD12 ' A' ' 55' ' ' LEU . 47.1 m-85 -107.09 127.74 53.75 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.288 -0.882 . . . . 0.12 109.529 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.53 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -110.93 140.21 45.62 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.047 -1.033 . . . . 0.22 110.056 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -109.77 129.89 55.57 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.52 -1.659 . . . . 1.13 106.52 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.6 t -125.37 135.09 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.193 -0.942 . . . . 0.15 110.109 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 52.5 t0 -98.19 117.44 32.57 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.745 -0.835 . . . . 1.05 108.745 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.5 m -65.01 -19.47 25.72 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 120.526 -1.359 . . . . 0.16 108.19 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.19 -41.19 11.13 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 1.08 111.949 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -97.49 -18.36 19.06 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.611 -1.306 . . . . 1.07 108.826 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -120.31 39.1 3.8 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 107.925 -1.139 . . . . 0.14 107.925 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -60.06 -19.56 53.59 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.745 -0.597 . . . . 1.47 109.702 -178.742 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.594 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -63.55 -35.76 81.54 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.894 -1.129 . . . . 1.05 109.066 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.594 HG23 ' OD1' ' A' ' 64' ' ' ASP . 13.2 t -73.4 -41.31 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.067 -1.021 . . . . 0.35 108.951 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.69 -41.91 78.52 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.64 -0.663 . . . . 0.26 110.638 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.0 p -60.01 -39.14 84.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.842 -1.161 . . . . 0.24 108.847 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -65.79 -40.06 91.59 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.352 -0.842 . . . . 2.06 109.465 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.61 -3.9 58.96 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.203 -0.935 . . . . 0.23 111.388 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 53.35 49.67 19.21 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.834 -1.166 . . . . 2.02 110.476 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.08 132.83 32.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 O-C-N 120.602 -1.311 . . . . 0.16 108.52 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -103.68 -12.16 17.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.396 -0.815 . . . . 1.6 110.67 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.508 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -158.4 155.36 28.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.709 -1.245 . . . . 0.14 110.905 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.44 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.9 p -129.8 154.58 81.06 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 108.007 -1.108 . . . . 0.15 108.007 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -77.04 141.92 70.8 Favored 'Cis proline' 0 N--CA 1.49 1.309 0 C-N-CA 123.666 -1.389 . . . . 0.16 112.462 -2.755 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.8 m -125.95 136.13 52.65 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.659 -0.867 . . . . 0.13 108.659 178.411 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.764 ' CD1' HD21 ' A' ' 97' ' ' LEU . 88.9 m-85 -111.75 132.95 54.31 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.505 -0.924 . . . . 0.2 108.505 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -123.83 143.23 50.46 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.661 -0.866 . . . . 0.29 108.661 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.401 ' CD2' HG22 ' A' ' 24' ' ' VAL . 59.4 m-85 -108.65 129.74 55.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.468 0.651 . . . . 0.14 110.722 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -124.15 142.26 51.37 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.86 -0.793 . . . . 0.15 108.86 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -146.44 127.05 14.2 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.531 -1.285 . . . . 1.68 107.531 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.8 mttt 60.07 28.88 18.48 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.433 -0.792 . . . . 1.22 109.282 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.94 14.42 82.02 Favored Glycine 0 N--CA 1.495 2.63 0 O-C-N 120.857 -1.152 . . . . 0.23 110.664 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 92.5 mt-30 -124.11 144.3 49.96 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.335 -1.097 . . . . 2.07 110.877 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -81.92 126.71 32.23 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.593 -0.692 . . . . 1.82 109.16 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.67 9.58 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.617 -0.677 . . . . 0.3 110.707 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.23 162.56 28.69 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 118.239 -1.934 . . . . 0.17 111.471 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -168.42 148.05 4.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.97 -0.752 . . . . 1.93 108.97 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.485 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 4.1 p90 -167.78 156.01 9.07 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.197 -0.94 . . . . 0.14 109.664 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.9 p -126.34 160.0 31.61 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.563 -0.71 . . . . 0.12 109.997 -179.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.44 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.14 141.51 5.78 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.471 -1.452 . . . . 0.12 109.471 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.492 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.16 65.41 2.13 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.288 -1.125 . . . . 0.18 110.056 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.4 t-20 -119.52 97.71 5.78 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.642 -0.873 . . . . 0.88 108.642 178.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -32.47 71.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.069 -1.019 . . . . 1.06 111.732 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -64.25 -30.05 71.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.082 -1.011 . . . . 1.61 109.321 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -60.42 -35.47 75.86 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.301 -0.629 . . . . 1.45 109.301 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.764 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.0 mt -59.79 -39.87 86.41 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.145 0.974 . . . . 0.19 108.797 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -63.24 -40.43 97.41 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.967 -0.693 . . . . 2.1 110.755 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -44.3 72.45 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.078 -1.013 . . . . 0.19 111.754 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.0 m -67.11 -38.55 85.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.771 -1.205 . . . . 0.2 109.819 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.7 mt -60.91 -49.93 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.187 -0.946 . . . . 0.16 108.494 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.01 -36.38 77.08 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 122.055 0.931 . . . . 0.95 109.074 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -67.2 -40.16 86.45 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.732 -0.605 . . . . 2.21 110.38 -178.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.3 mt -99.36 -4.7 31.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.12 -0.988 . . . . 0.25 111.225 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.497 1.901 0 O-C-N 120.207 -1.558 . . . . 1.08 109.366 -178.71 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo . . . . . 0 N--CA 1.493 1.468 0 CA-C-O 121.002 0.334 . . . . 1.46 112.605 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.1 124.38 33.18 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.848 -1.158 . . . . 0.88 108.937 179.243 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.44 HG22 ' H ' ' B' ' 63' ' ' LYS . 24.8 m -109.96 129.9 55.6 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.298 -0.876 . . . . 0.7 109.153 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -63.83 -30.38 71.48 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.221 -0.924 . . . . 0.61 109.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.44 ' H ' HG22 ' B' ' 61' ' ' THR . 41.4 mmtm -59.49 -27.02 65.76 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.524 -0.735 . . . . 1.31 109.458 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.44 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.8 mm -128.9 141.57 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.896 -0.503 . . . . 0.15 110.169 -179.119 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.5 m -101.21 128.25 47.42 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.799 -1.556 . . . . 0.19 106.799 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.9 m -79.84 141.1 36.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.759 -1.213 . . . . 0.2 110.442 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.508 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.2 m95 -74.47 -12.23 60.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.217 -0.927 . . . . 0.21 109.316 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 44.9 m-20 -51.29 -12.1 0.13 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.145 -0.972 . . . . 0.49 108.919 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.454 ' N ' ' O ' ' B' ' 67' ' ' TRP . 15.6 m -60.28 141.81 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.937 . . . . 1.04 109.739 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -59.87 -37.52 79.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.135 -0.978 . . . . 1.36 109.462 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.909 -1.495 . . . . 2.32 109.761 -179.813 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.0 tpp . . . . . 0 N--CA 1.493 1.695 0 N-CA-C 109.46 -0.571 . . . . 2.88 109.46 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.523 HG12 ' N ' ' A' ' 3' ' ' LYS . 53.9 t -98.75 163.98 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.493 -0.755 . . . . 0.45 109.153 179.585 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.523 ' N ' HG12 ' A' ' 2' ' ' VAL . 48.3 tptt -130.8 129.89 42.98 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.486 -0.931 . . . . 1.67 108.486 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.41 125.1 41.84 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.227 -0.921 . . . . 0.31 108.829 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.9 mm -103.03 113.6 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 108.382 -0.97 . . . . 0.19 108.382 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -96.88 -0.64 47.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.011 -1.056 . . . . 2.25 109.843 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -154.7 156.53 36.56 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.014 -1.054 . . . . 0.15 110.802 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -63.62 -31.95 73.27 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.289 -1.004 . . . . 1.65 108.289 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.451 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 59.3 m -57.15 -48.21 79.25 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.403 -0.919 . . . . 0.23 108.826 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.36 -28.82 66.54 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.205 -0.934 . . . . 0.17 108.959 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.476 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.0 t80 -59.9 -43.94 94.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.323 -0.861 . . . . 0.14 109.272 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -65.59 -42.55 91.57 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.823 -0.751 . . . . 1.31 109.052 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.55 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.67 -40.05 95.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 1.77 110.394 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.24 90.86 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.137 -0.977 . . . . 0.15 109.239 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.476 HD11 ' CE2' ' A' ' 11' ' ' PHE . 80.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.222 -1.029 . . . . 0.17 108.222 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -70.07 -35.31 74.13 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.926 -0.71 . . . . 1.07 110.127 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.05 -36.65 77.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.095 -1.003 . . . . 0.18 110.001 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.32 -34.76 77.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.918 -1.114 . . . . 0.17 109.507 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.37 -124.52 19.2 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 110.125 -1.19 . . . . 0.2 110.125 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -91.92 5.2 50.97 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.943 -1.328 . . . . 1.07 110.307 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -77.29 149.33 35.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.004 -1.06 . . . . 1.5 109.021 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.681 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -61.2 156.49 18.31 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.614 -1.254 . . . . 0.47 107.614 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.647 ' H ' HD23 ' A' ' 22' ' ' LEU . 84.5 t -143.78 113.04 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.807 -1.183 . . . . 0.17 109.205 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.3 t -101.22 142.39 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.392 -0.966 . . . . 0.14 108.392 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -125.42 121.96 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.218 -0.926 . . . . 0.13 109.582 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -98.82 120.9 40.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.355 -0.841 . . . . 1.05 110.346 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -95.94 24.43 5.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.73 109.49 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -59.22 145.79 41.53 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.154 -0.966 . . . . 0.3 110.545 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.654 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.21 123.3 31.33 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.406 -0.961 . . . . 0.22 108.406 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.91 -30.96 70.42 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.91 -1.144 . . . . 0.3 107.91 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.654 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 55.8 p-90 -71.38 -26.38 62.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.373 -0.829 . . . . 0.26 110.6 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.27 123.68 29.83 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.803 -1.186 . . . . 0.26 107.967 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.423 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.08 -53.07 32.06 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.506 -0.854 . . . . 0.23 111.534 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.4 Cg_exo -51.55 -31.96 41.9 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 CA-C-N 118.704 1.252 . . . . 0.31 112.095 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.38 -50.67 10.48 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.377 -0.827 . . . . 0.24 109.725 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.67 -39.27 83.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.282 -0.887 . . . . 1.59 109.468 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.3 ttm -57.6 -27.7 62.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.474 -0.766 . . . . 2.1 109.622 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.559 HG22 ' O ' ' A' ' 38' ' ' ILE . 66.3 mt -85.29 -2.99 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.49 111.374 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.35 -30.13 6.22 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 120.447 -1.408 . . . . 0.8 113.454 -179.289 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 33.8 Cg_exo -59.28 -41.62 57.47 Favored 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 121.52 1.578 . . . . 0.28 113.642 -176.91 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.98 -45.27 74.59 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 117.589 -1.644 . . . . 0.37 107.771 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -59.69 -54.37 47.14 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.202 -0.936 . . . . 0.16 110.239 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.41 ' ND1' HG21 ' A' ' 2' ' ' VAL . 34.4 t60 -68.24 -40.0 82.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.546 -0.721 . . . . 0.32 110.866 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.5 m -61.18 -39.03 88.61 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.823 -1.173 . . . . 0.22 110.755 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -61.93 -22.51 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.143 -0.973 . . . . 0.22 110.901 -178.723 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.9 m -54.12 -35.45 62.2 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 120.82 -1.175 . . . . 0.16 108.457 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -88.26 -14.78 37.55 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.485 -0.759 . . . . 2.16 108.961 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.34 -36.21 39.8 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 106.955 -1.498 . . . . 1.78 106.955 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.413 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 78.0 m-85 -124.82 68.83 1.1 Allowed 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.29 -1.374 . . . . 0.25 107.29 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 71.7 p -65.11 -8.5 16.97 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.496 -0.752 . . . . 0.22 109.188 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -89.02 6.09 41.34 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.456 HG13 ' HB3' ' A' ' 22' ' ' LEU . 41.6 t -126.09 145.56 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 107.441 -1.318 . . . . 0.24 107.441 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.0 122.24 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.159 0 O-C-N 121.164 -0.96 . . . . 0.15 109.456 -178.611 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.581 ' C ' HD12 ' A' ' 55' ' ' LEU . 38.1 m-85 -103.12 125.17 49.71 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.317 -0.864 . . . . 0.12 109.549 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.581 HD12 ' C ' ' A' ' 54' ' ' PHE . 6.0 mp -110.09 142.04 42.1 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -0.999 . . . . 0.22 109.585 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -109.41 132.33 54.23 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 106.897 -1.52 . . . . 1.13 106.897 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.2 t -130.28 134.17 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 121.231 -0.918 . . . . 0.15 110.856 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 40.8 t0 -96.35 120.85 37.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.564 -0.71 . . . . 1.05 109.44 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.4 m -67.81 -19.35 24.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.635 -1.29 . . . . 0.16 108.464 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.9 m-20 -92.24 -43.68 9.17 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.483 -0.761 . . . . 1.08 111.446 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.44 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 33.4 m-20 -93.25 -21.87 19.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.535 -1.353 . . . . 1.07 108.355 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -117.61 38.57 3.57 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 107.982 -1.118 . . . . 0.14 107.982 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -59.83 -22.19 61.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.814 -0.554 . . . . 1.47 109.903 -178.757 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.601 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -63.93 -38.86 92.63 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.123 -0.986 . . . . 1.05 108.943 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.601 HG23 ' OD1' ' A' ' 64' ' ' ASP . 12.0 t -72.48 -43.98 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 O-C-N 121.319 -0.863 . . . . 0.35 109.952 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -40.16 75.63 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.564 -0.71 . . . . 0.26 111.118 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -63.02 -32.69 74.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.909 -1.119 . . . . 0.24 108.884 -179.392 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -39.89 95.64 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.839 -0.8 . . . . 2.06 108.839 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.28 0.52 56.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.601 -0.687 . . . . 0.23 109.872 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 54.52 50.17 16.64 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.273 -0.892 . . . . 2.02 109.718 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.37 131.35 28.88 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 C-N-CA 118.153 -1.419 . . . . 0.16 108.732 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -104.86 -10.48 17.31 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.94 -0.475 . . . . 1.6 110.15 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.93 152.28 15.24 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.834 -1.166 . . . . 0.14 110.915 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -124.99 154.12 71.24 Favored Pre-proline 0 N--CA 1.5 2.07 0 N-CA-C 107.388 -1.338 . . . . 0.15 107.388 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -77.37 144.21 76.97 Favored 'Cis proline' 0 N--CA 1.487 1.107 0 C-N-CA 123.601 -1.416 . . . . 0.16 112.062 -2.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.3 m -129.96 133.87 47.08 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.199 -1.037 . . . . 0.13 108.199 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.425 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 84.1 m-85 -112.46 132.24 55.16 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.356 -0.979 . . . . 0.2 108.356 -179.339 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -123.15 142.79 50.51 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.285 -0.884 . . . . 0.29 108.976 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -108.17 132.12 53.95 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-O 121.712 0.768 . . . . 0.14 111.395 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -125.77 145.44 50.2 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.239 -0.652 . . . . 0.15 109.239 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -147.7 131.44 16.96 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.251 -1.389 . . . . 1.68 107.251 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 59.0 mttp 56.22 26.76 10.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.564 -1.273 . . . . 1.22 107.564 -177.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.07 17.46 79.68 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 110.354 -1.098 . . . . 0.23 110.354 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 13.7 mm100 -117.93 136.71 53.31 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.47 -1.018 . . . . 2.07 109.869 179.899 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -79.41 122.21 26.13 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.119 -0.988 . . . . 1.82 108.457 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 19.0 m -122.82 11.88 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.595 -0.691 . . . . 0.3 111.304 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.26 155.46 15.99 Favored Glycine 0 N--CA 1.496 2.694 0 C-N-CA 118.589 -1.767 . . . . 0.17 111.254 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.512 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.54 148.18 7.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.809 -0.818 . . . . 1.93 109.478 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.512 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.8 p90 -167.05 159.03 12.77 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.353 -0.842 . . . . 0.14 110.05 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.5 p -127.08 161.41 28.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.647 -0.658 . . . . 0.12 109.486 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.508 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.77 141.71 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 108.995 -1.642 . . . . 0.12 108.995 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.511 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -80.16 67.12 5.87 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.391 -1.064 . . . . 0.18 110.078 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.1 t-20 -120.25 99.37 6.55 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.355 -0.98 . . . . 0.88 108.355 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.493 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -67.82 -32.25 72.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 1.06 111.726 -178.822 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -65.97 -28.07 68.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.594 -1.317 . . . . 1.61 109.643 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.46 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 21.6 ttmt -61.0 -35.26 76.37 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 108.779 -0.822 . . . . 1.45 108.779 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 75.1 mt -59.64 -38.83 82.44 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.101 0.953 . . . . 0.19 108.949 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 98' ' ' GLU . . . . . 0.413 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 9.6 tp10 -63.23 -43.52 97.83 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 120.109 -0.637 . . . . 2.1 111.53 -177.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.11 -43.64 77.98 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.988 -1.07 . . . . 0.19 111.613 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.08 -40.13 94.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.739 -1.226 . . . . 0.2 109.739 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.0 mt -60.05 -50.02 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.155 -1.054 . . . . 0.16 108.155 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.477 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.9 t-20 -59.7 -35.3 74.23 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 122.041 0.924 . . . . 0.95 108.588 178.811 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -67.89 -39.84 83.59 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.532 -0.73 . . . . 2.21 109.971 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.681 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.8 mt -99.99 -0.89 38.42 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.214 -0.929 . . . . 0.25 111.273 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.7 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 120.481 -1.387 . . . . 1.08 109.265 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo . . . . . 0 N--CA 1.495 1.593 0 CA-C-O 121.106 0.378 . . . . 1.46 112.611 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.27 124.98 40.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.208 -0.933 . . . . 0.88 109.189 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.433 HG22 ' H ' ' B' ' 63' ' ' LYS . 27.5 m -112.34 130.64 55.89 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.53 -0.732 . . . . 0.7 109.529 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.46 -28.65 68.05 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.359 -0.838 . . . . 0.61 109.883 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.433 ' H ' HG22 ' B' ' 61' ' ' THR . 68.3 mmtt -59.05 -26.83 64.95 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.923 -1.111 . . . . 1.31 109.559 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.508 HD11 ' HA2' ' A' ' 91' ' ' GLY . 38.3 mm -128.77 141.05 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 N-CA-C 109.541 -0.54 . . . . 0.15 109.541 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 34.7 m -98.47 127.27 44.33 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.837 -1.542 . . . . 0.19 106.837 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -77.54 139.36 39.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.688 -1.258 . . . . 0.2 110.738 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.472 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 21.1 m95 -74.52 -10.9 60.01 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.122 -0.987 . . . . 0.21 109.253 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 40.3 m-20 -51.64 -12.23 0.17 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.425 -0.797 . . . . 0.49 109.16 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.456 ' N ' ' C ' ' B' ' 67' ' ' TRP . 11.4 m -59.46 136.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.22 -0.925 . . . . 1.04 110.204 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -59.85 -40.12 87.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.258 -0.901 . . . . 1.36 109.343 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.513 -1.435 . . . . 2.32 109.513 -179.745 . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.6 mmm . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.062 -0.718 . . . . 2.88 109.062 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.1 148.58 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 121.178 -0.951 . . . . 0.45 109.757 -179.479 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -130.4 130.03 43.82 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.881 -0.785 . . . . 1.67 108.881 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -94.71 126.16 39.84 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.898 -1.519 . . . . 0.31 106.898 178.074 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.9 mm -100.19 115.62 41.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 121.341 -0.85 . . . . 0.19 108.743 -179.786 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -98.55 -1.61 40.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.284 -0.885 . . . . 2.25 110.091 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.52 157.45 39.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.024 -1.048 . . . . 0.15 111.273 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.536 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 27.8 ttpt -66.74 -31.72 72.55 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.729 -1.211 . . . . 1.65 107.729 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 23.8 m -56.31 -48.11 77.36 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.703 -0.851 . . . . 0.23 108.703 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.1 -32.33 68.91 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.935 -0.765 . . . . 0.17 108.935 178.791 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.547 ' CE2' HD11 ' A' ' 15' ' ' LEU . 53.8 t80 -57.02 -42.86 81.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.887 . . . . 0.14 108.802 -179.15 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.01 -42.21 89.98 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 109.024 -0.732 . . . . 1.31 109.024 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.04 -38.56 91.28 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.201 0.525 . . . . 1.77 110.913 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.48 -40.53 89.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.059 -1.026 . . . . 0.15 109.176 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.547 HD11 ' CE2' ' A' ' 11' ' ' PHE . 75.0 mt -60.89 -39.98 91.3 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.412 -0.805 . . . . 0.17 109.412 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -70.24 -34.66 73.11 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.458 -0.776 . . . . 1.07 110.164 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.2 78.0 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.18 110.088 -178.773 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.44 -32.41 71.34 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.279 -0.888 . . . . 0.17 109.299 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.06 -127.25 27.21 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.197 -1.561 . . . . 0.2 109.197 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -90.79 4.08 52.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.109 -1.23 . . . . 1.07 110.693 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.6 mttm -75.13 148.97 39.21 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.846 -1.159 . . . . 1.5 109.633 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.7 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.01 155.85 19.16 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.333 -1.358 . . . . 0.47 107.333 179.591 . . . . . . . . 3 3 . 1 . 021 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.7 ' H ' HD23 ' A' ' 22' ' ' LEU . 47.3 t -145.13 121.77 4.15 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 N-CA-C 107.826 -1.175 . . . . 0.17 107.826 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.2 t -110.29 141.07 26.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 108.062 -1.088 . . . . 0.14 108.062 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.8 t -122.51 121.38 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.337 -0.852 . . . . 0.13 109.199 -179.45 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.569 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.7 t70 -99.34 109.31 21.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.46 -0.775 . . . . 1.05 111.114 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -89.88 104.66 17.2 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.688 -1.597 . . . . 0.73 106.688 176.916 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.2 m -129.99 144.21 51.21 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.622 -0.881 . . . . 0.3 108.622 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.618 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.31 122.39 27.89 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.461 -1.311 . . . . 0.22 107.461 178.93 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -64.43 -33.13 75.15 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.209 -1.034 . . . . 0.3 108.209 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.618 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.0 p-90 -71.8 -27.25 62.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.414 -0.803 . . . . 0.26 110.541 179.283 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -82.69 115.82 21.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.981 -1.075 . . . . 0.26 108.549 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.457 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.42 -51.9 54.89 Favored Glycine 0 N--CA 1.484 1.876 0 C-N-CA 120.535 -0.841 . . . . 0.23 111.329 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -52.03 -35.48 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 CA-C-N 118.689 1.245 . . . . 0.31 112.734 -179.153 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.83 -54.83 6.31 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.149 -0.969 . . . . 0.24 110.187 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -61.19 -36.28 79.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.114 -0.991 . . . . 1.59 109.76 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 30.0 ttp -58.1 -27.39 63.65 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.26 -0.9 . . . . 2.1 109.041 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.551 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -87.52 -9.19 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 112.178 0.436 . . . . 0.49 112.178 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 30.1 pttt -68.2 -30.45 2.66 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 119.965 -1.709 . . . . 0.8 113.437 -177.545 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.6 Cg_exo -49.83 -37.55 45.63 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 CA-C-N 121.843 1.694 . . . . 0.28 112.826 -178.54 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -68.09 -42.88 79.67 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 117.359 -1.736 . . . . 0.37 106.857 178.35 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -61.13 -53.64 54.54 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.349 -0.844 . . . . 0.16 109.815 178.358 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -67.73 -40.4 84.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.32 110.78 -179.622 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.409 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 71.2 m -60.44 -39.92 89.24 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.117 -0.989 . . . . 0.22 111.442 -179.611 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.91 -20.2 65.67 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.093 -1.004 . . . . 0.22 110.88 -177.986 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.7 m -51.28 -39.86 57.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.851 -1.156 . . . . 0.16 109.211 -178.559 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -81.33 -17.44 49.16 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.246 -0.909 . . . . 2.16 109.588 179.484 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -76.87 -38.4 53.72 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.273 -1.38 . . . . 1.78 107.273 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -121.21 68.72 0.89 Allowed 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 106.298 -1.742 . . . . 0.25 106.298 177.672 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -63.11 -9.02 9.03 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.707 -0.849 . . . . 0.22 108.707 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -91.14 8.53 35.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.684 -0.635 . . . . 1.13 109.433 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 22' ' ' LEU . 49.4 t -126.86 147.02 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 107.849 -1.167 . . . . 0.24 107.849 179.284 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.2 mm -99.53 120.96 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 120.987 -1.071 . . . . 0.15 109.794 -178.422 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.561 ' C ' HD12 ' A' ' 55' ' ' LEU . 57.1 m-85 -102.9 123.89 47.38 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.38 -0.825 . . . . 0.12 109.728 179.714 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.561 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -111.73 142.06 44.55 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.038 -1.039 . . . . 0.22 110.225 178.633 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.34 133.04 53.64 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 107.498 -1.297 . . . . 1.13 107.498 177.868 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.8 t -128.99 139.05 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.312 -0.868 . . . . 0.15 111.604 -178.149 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.613 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.1 t0 -102.28 120.04 39.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.135 -0.691 . . . . 1.05 109.135 179.433 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -68.13 -18.65 23.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.797 -1.189 . . . . 0.16 108.471 178.823 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -92.37 -41.53 10.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.387 -0.821 . . . . 1.08 111.608 -178.736 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -95.93 -15.05 22.62 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.602 -1.311 . . . . 1.07 108.122 179.085 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.64 39.69 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.228 -1.397 . . . . 0.14 107.228 179.031 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -60.98 -20.1 61.95 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.307 0.575 . . . . 1.47 109.48 -178.748 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.536 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 5.0 p-10 -67.4 -39.95 85.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.261 -0.899 . . . . 1.05 109.653 179.505 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -73.13 -42.55 58.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.659 0.743 . . . . 0.35 109.655 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -39.97 72.62 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.491 -0.756 . . . . 0.26 110.431 -179.39 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.7 p -60.46 -35.77 76.67 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.096 -1.003 . . . . 0.24 108.766 -179.537 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -62.41 -39.88 94.7 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.509 -0.745 . . . . 2.06 109.393 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.06 -1.73 57.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 0.23 111.164 -178.878 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 54.85 50.02 16.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.078 -1.014 . . . . 2.02 109.391 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.3 t -66.79 131.54 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.881 -1.137 . . . . 0.16 109.188 -178.931 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -103.95 -10.77 17.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.626 -0.672 . . . . 1.6 110.23 -179.534 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.58 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -162.24 155.32 20.24 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.829 -1.169 . . . . 0.14 110.434 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -130.1 153.86 81.18 Favored Pre-proline 0 N--CA 1.501 2.077 0 N-CA-C 107.818 -1.178 . . . . 0.15 107.818 179.017 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -75.66 142.56 74.39 Favored 'Cis proline' 0 N--CA 1.496 1.624 0 C-N-CA 123.73 -1.363 . . . . 0.16 113.192 -2.273 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.443 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -125.71 132.25 52.42 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.147 -1.057 . . . . 0.13 108.147 177.602 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.569 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 89.0 m-85 -108.2 130.64 55.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.742 -0.836 . . . . 0.2 108.742 -179.261 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -122.38 141.25 51.77 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.135 -1.061 . . . . 0.29 108.135 179.438 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -108.66 132.41 53.94 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.559 0.695 . . . . 0.14 110.643 -178.818 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -125.95 146.01 50.04 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.497 0.665 . . . . 0.15 109.925 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -149.59 131.14 14.85 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 107.975 -1.12 . . . . 1.68 107.975 179.062 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 57.34 27.52 13.9 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.467 -0.938 . . . . 1.22 108.467 -178.905 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.96 21.47 76.22 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.887 -1.285 . . . . 0.23 109.887 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 90.3 mt-30 -127.79 142.68 51.24 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -1.091 . . . . 2.07 110.043 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.447 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 76.3 tttt -79.96 129.79 34.77 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.014 -1.054 . . . . 1.82 109.166 179.665 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.4 m -123.01 4.6 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.637 -0.665 . . . . 0.3 110.741 -179.166 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 173.84 161.03 23.25 Favored Glycine 0 N--CA 1.495 2.577 0 C-N-CA 118.218 -1.944 . . . . 0.17 111.844 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.447 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 58.2 tt0 -163.9 151.88 12.88 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.714 -0.874 . . . . 1.93 109.479 179.04 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.473 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 6.7 p90 -166.72 157.15 11.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.435 -0.791 . . . . 0.14 109.781 177.983 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -127.51 163.05 24.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.812 0.815 . . . . 0.12 110.753 -178.606 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.477 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.63 143.96 7.15 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.208 -1.557 . . . . 0.12 109.208 179.373 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.85 67.14 2.21 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.364 -1.08 . . . . 0.18 110.403 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -120.2 91.19 3.48 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 108.455 -0.943 . . . . 0.88 108.455 178.197 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.73 72.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.022 -1.048 . . . . 1.06 111.353 -179.162 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -65.29 -29.84 70.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.753 -1.217 . . . . 1.61 109.961 -179.703 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.473 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 56.1 tttm -60.32 -35.8 76.44 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.374 -0.829 . . . . 1.45 109.296 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' A' ' 77' ' ' PHE . 58.0 mt -58.09 -39.24 78.1 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.738 -0.838 . . . . 0.19 108.738 179.685 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -61.8 -43.67 98.39 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 119.883 -0.727 . . . . 2.1 110.964 -178.407 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.39 -43.23 77.76 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.011 -1.055 . . . . 0.19 111.357 -178.709 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -64.63 -39.55 93.89 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.824 -1.173 . . . . 0.2 110.158 -178.285 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.44 -48.38 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.126 -0.984 . . . . 0.16 108.428 179.168 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.452 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.6 t-20 -59.95 -37.05 78.41 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.104 0.954 . . . . 0.95 108.689 179.226 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -67.33 -38.81 85.51 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.79 -0.569 . . . . 2.21 110.088 -178.341 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.652 ' HB2' HD11 ' A' ' 22' ' ' LEU . 79.6 mt -100.07 -2.88 33.16 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.918 -1.114 . . . . 0.25 111.367 -179.269 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.3 p . . . . . 0 N--CA 1.496 1.845 0 O-C-N 120.48 -1.388 . . . . 1.08 109.347 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.496 1.647 0 CA-C-O 121.19 0.412 . . . . 1.46 112.262 . . . . . . . . . 0 0 . 1 . 021 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.76 126.82 39.16 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.051 -1.03 . . . . 0.88 108.875 179.429 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.438 HG22 ' H ' ' B' ' 63' ' ' LYS . 26.7 m -109.36 128.91 55.48 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.389 -0.82 . . . . 0.7 109.82 -179.428 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.8 -29.81 70.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.487 -0.758 . . . . 0.61 109.662 -179.917 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.438 ' H ' HG22 ' B' ' 61' ' ' THR . 30.1 mmtp -59.27 -21.33 59.46 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 1.31 109.332 -179.515 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.58 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 30.7 mm -130.74 141.07 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 N-CA-C 109.497 -0.557 . . . . 0.15 109.497 -179.607 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 64.9 m -95.91 131.66 42.02 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.518 -1.289 . . . . 0.19 107.518 177.828 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -80.18 139.32 36.83 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.811 -1.18 . . . . 0.2 111.384 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.455 ' C ' ' N ' ' B' ' 69' ' ' VAL . 22.1 m95 -78.03 -9.46 59.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.061 -1.024 . . . . 0.21 108.813 178.937 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 43.8 m-20 -53.8 -11.35 0.39 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.136 -0.978 . . . . 0.49 108.525 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.455 ' N ' ' C ' ' B' ' 67' ' ' TRP . 31.5 m -61.62 134.16 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.431 -0.793 . . . . 1.04 109.927 -179.977 . . . . . . . . 2 2 . 1 . 021 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.084 -1.01 . . . . 1.36 109.501 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 108.964 -1.654 . . . . 2.32 108.964 -179.389 . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.1 mmm . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 121.168 0.508 . . . . 2.88 109.682 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.551 HG12 ' N ' ' A' ' 3' ' ' LYS . 69.5 t -99.17 163.6 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.557 -0.714 . . . . 0.45 110.089 -179.559 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.551 ' N ' HG12 ' A' ' 2' ' ' VAL . 27.1 tptp -129.98 125.09 34.54 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 108.185 -1.042 . . . . 1.67 108.185 179.396 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -95.06 123.75 38.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.008 -1.058 . . . . 0.31 109.027 179.788 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.87 111.97 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.513 -0.921 . . . . 0.19 108.513 179.509 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -96.64 -0.2 48.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.168 -0.957 . . . . 2.25 110.212 -179.355 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.43 156.89 36.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.787 -1.196 . . . . 0.15 110.803 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.457 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 33.5 ttmt -64.04 -32.76 74.42 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.8 -1.185 . . . . 1.65 107.8 177.866 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.9 m -56.13 -48.34 76.43 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.425 -0.91 . . . . 0.23 108.963 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.55 -31.36 70.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.247 -0.908 . . . . 0.17 109.28 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.498 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.2 t80 -58.99 -44.66 91.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.14 109.549 -178.906 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -64.11 -40.99 97.4 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.202 -1.036 . . . . 1.31 108.202 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -65.15 -36.7 85.06 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.562 0.696 . . . . 1.77 110.344 179.401 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.79 -43.84 78.76 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.795 -0.817 . . . . 0.15 108.795 -179.092 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.498 HD11 ' CE2' ' A' ' 11' ' ' PHE . 89.6 mt -60.67 -39.5 88.65 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.376 -0.972 . . . . 0.17 108.376 178.914 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.01 -32.96 72.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.428 -0.795 . . . . 1.07 109.962 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.2 63.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.13 -0.981 . . . . 0.18 110.539 -179.211 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.52 -30.08 70.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.05 -1.031 . . . . 0.17 109.555 -179.682 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.9 -127.37 24.96 Favored Glycine 0 N--CA 1.487 2.089 0 N-CA-C 110.08 -1.208 . . . . 0.2 110.08 -179.895 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -92.78 4.24 54.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.362 -1.081 . . . . 1.07 110.44 -179.139 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -75.45 151.33 38.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.172 -0.955 . . . . 1.5 109.388 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.677 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -61.3 156.03 19.78 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 107.54 -1.282 . . . . 0.47 107.54 -179.732 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.634 ' H ' HD23 ' A' ' 22' ' ' LEU . 60.7 t -142.69 119.57 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.064 -1.023 . . . . 0.17 108.469 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -105.89 139.82 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 N-CA-C 107.72 -1.215 . . . . 0.14 107.72 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 32.9 t -123.58 120.3 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.151 -0.968 . . . . 0.13 109.295 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -98.53 118.51 35.39 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.375 -0.828 . . . . 1.05 110.079 179.632 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -94.63 24.83 4.34 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.09 -1.007 . . . . 0.73 109.803 179.16 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.408 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.8 m -60.16 147.69 38.86 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.01 -1.056 . . . . 0.3 110.618 -179.011 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.774 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.83 124.0 31.09 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.602 -1.259 . . . . 0.22 107.602 178.81 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.4 t -66.96 -29.2 68.99 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 108.098 -1.075 . . . . 0.3 108.098 179.694 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.774 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 63.9 p-90 -75.53 -19.09 59.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.521 -0.737 . . . . 0.26 110.435 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.424 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 7.0 t -87.29 111.7 21.31 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.668 -1.234 . . . . 0.26 107.668 179.971 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.71 -50.93 62.42 Favored Glycine 0 N--CA 1.486 1.992 0 C-N-CA 120.557 -0.83 . . . . 0.23 111.379 -178.13 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.78 -35.94 50.07 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 CA-C-N 118.964 1.382 . . . . 0.31 111.234 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.54 -45.11 22.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.378 -0.826 . . . . 0.24 109.826 179.222 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -59.95 -31.34 69.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.162 -0.961 . . . . 1.59 108.841 179.621 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.521 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.2 tmm? -60.37 -29.59 69.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.582 -0.699 . . . . 2.1 109.642 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.465 HD11 ' HB1' ' A' ' 92' ' ' ALA . 9.5 mt -81.12 -5.56 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.741 -0.6 . . . . 0.49 111.106 -179.434 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.42 -30.86 7.78 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 119.881 -1.762 . . . . 0.8 112.971 -176.787 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.0 Cg_exo -59.72 -38.46 80.87 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 CA-C-N 121.722 1.651 . . . . 0.28 112.29 -178.529 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -71.43 -50.82 28.01 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.412 -1.315 . . . . 0.37 108.759 179.449 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.7 -48.64 80.88 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.217 -0.927 . . . . 0.16 109.252 179.129 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -67.5 -44.74 77.75 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.681 -0.637 . . . . 0.32 110.969 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 63.4 m -62.13 -36.42 81.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.953 -1.092 . . . . 0.22 110.35 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 mt -60.13 -26.12 66.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.198 -0.939 . . . . 0.22 110.477 -178.631 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.5 m -53.45 -41.79 66.5 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.79 -1.194 . . . . 0.16 108.428 -179.495 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.415 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 39.9 mp0 -86.06 -16.86 36.79 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.299 -0.876 . . . . 2.16 110.049 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -78.03 -37.22 47.39 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 106.516 -1.661 . . . . 1.78 106.516 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -123.12 70.03 1.02 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.266 -1.383 . . . . 0.25 107.266 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.6 p -65.67 -7.83 17.42 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.835 -0.802 . . . . 0.22 108.835 -179.498 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -88.47 3.9 48.47 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.685 -0.857 . . . . 1.13 108.685 179.023 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.414 HG13 ' HB3' ' A' ' 22' ' ' LEU . 39.7 t -126.4 145.56 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.562 -1.273 . . . . 0.24 107.562 178.909 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mm -98.67 121.86 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.045 . . . . 0.15 109.574 -178.32 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.607 ' C ' HD12 ' A' ' 55' ' ' LEU . 39.9 m-85 -102.63 123.86 47.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.24 -0.912 . . . . 0.12 109.747 179.525 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.607 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -110.39 140.16 44.89 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.266 -0.896 . . . . 0.22 109.696 178.957 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -109.98 130.0 55.59 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 106.831 -1.544 . . . . 1.13 106.831 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.9 136.72 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 CA-C-O 121.51 0.671 . . . . 0.15 110.474 -178.232 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.637 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.8 t0 -98.92 121.69 41.2 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 1.05 109.729 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -68.31 -17.49 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 120.98 -1.075 . . . . 0.16 108.702 179.02 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.7 m-20 -94.48 -41.99 9.08 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.525 -0.735 . . . . 1.08 111.591 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -96.91 -13.86 22.16 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.644 -1.285 . . . . 1.07 108.476 179.506 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.63 37.88 4.31 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.052 -1.462 . . . . 0.14 107.052 179.6 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.28 -21.85 62.43 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.972 -0.751 . . . . 1.47 108.972 -178.961 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.457 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 2.6 p30 -64.86 -39.64 93.87 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.134 -0.979 . . . . 1.05 108.964 179.215 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.5 t -73.59 -44.13 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.394 -0.816 . . . . 0.35 109.781 -179.65 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.27 72.03 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.381 -0.824 . . . . 0.26 110.71 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.8 p -61.2 -32.86 72.62 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.998 -1.064 . . . . 0.24 109.091 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -64.65 -39.92 94.54 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.488 -0.757 . . . . 2.06 110.19 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.81 1.66 53.34 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.292 -0.88 . . . . 0.23 110.677 -178.647 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 55.79 49.64 15.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.02 109.58 -179.538 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.77 130.65 30.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 C-N-CA 118.468 -1.293 . . . . 0.16 108.373 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -104.53 -10.8 17.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.628 -0.67 . . . . 1.6 109.968 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.478 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -161.78 155.85 22.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.9 -1.125 . . . . 0.14 110.991 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.68 156.26 79.08 Favored Pre-proline 0 N--CA 1.498 1.974 0 N-CA-C 107.819 -1.178 . . . . 0.15 107.819 179.087 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -76.06 139.67 61.78 Favored 'Cis proline' 0 N--CA 1.497 1.681 0 C-N-CA 123.969 -1.263 . . . . 0.16 112.611 -2.489 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -124.43 135.63 53.41 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 108.772 -0.825 . . . . 0.13 108.772 178.391 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.697 ' CD1' HD21 ' A' ' 97' ' ' LEU . 90.1 m-85 -113.12 131.75 55.71 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 109.121 -0.696 . . . . 0.2 109.121 -179.572 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -122.09 140.09 52.93 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.139 -1.06 . . . . 0.29 108.139 178.985 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -107.65 133.41 52.12 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.775 -0.578 . . . . 0.14 110.198 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -126.23 148.65 49.43 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.013 -0.736 . . . . 0.15 109.013 179.136 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -148.58 126.82 12.17 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 107.644 -1.243 . . . . 1.68 107.644 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.1 mttp 57.63 25.23 11.42 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.704 -1.221 . . . . 1.22 107.704 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.5 16.88 77.03 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 110.096 -1.202 . . . . 0.23 110.096 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -116.23 135.67 53.7 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.482 -1.011 . . . . 2.07 109.964 -179.628 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.461 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 80.9 tttt -81.54 122.5 27.65 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.307 -0.997 . . . . 1.82 108.307 178.32 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.3 m -123.29 9.87 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.648 -0.658 . . . . 0.3 110.811 -179.266 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.56 151.67 9.72 Favored Glycine 0 N--CA 1.499 2.885 0 C-N-CA 118.184 -1.96 . . . . 0.17 112.201 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.461 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 67.9 tt0 -164.48 151.22 11.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.684 -0.892 . . . . 1.93 109.341 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 21.5 p90 -163.21 161.27 24.82 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.768 -0.827 . . . . 0.14 108.768 177.423 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -125.92 160.05 30.97 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.554 0.692 . . . . 0.12 110.059 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.5 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.76 141.97 5.8 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.851 -1.699 . . . . 0.12 108.851 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.73 65.28 4.85 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.101 -1.235 . . . . 0.18 109.818 -179.553 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.9 t-20 -119.46 100.21 7.15 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.142 -1.058 . . . . 0.88 108.142 178.538 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.443 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.09 -32.36 72.63 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.346 -0.846 . . . . 1.06 111.538 -179.026 . . . . . . . . 3 3 . 1 . 022 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.48 -29.55 70.22 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.968 -1.082 . . . . 1.61 109.812 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.502 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 78.2 tttt -60.18 -38.28 82.75 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.982 -0.748 . . . . 1.45 108.982 -179.153 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' CD1' ' A' ' 77' ' ' PHE . 44.1 mt -57.14 -39.43 75.17 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.993 0.902 . . . . 0.19 108.743 179.431 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -61.66 -41.99 98.29 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 120.074 -0.65 . . . . 2.1 110.632 -177.989 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.41 -44.09 75.78 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.261 -0.899 . . . . 0.19 111.227 -179.095 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.2 m -66.16 -40.01 90.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.899 -1.126 . . . . 0.2 109.903 -178.445 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -60.92 -49.73 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 107.987 -1.116 . . . . 0.16 107.987 178.883 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.5 t-20 -59.95 -35.35 74.76 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.853 0.835 . . . . 0.95 108.752 178.877 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -67.19 -39.99 86.46 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.715 -0.616 . . . . 2.21 110.019 -178.74 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.0 mt -100.25 -1.87 35.26 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.316 -0.865 . . . . 0.25 111.206 -178.979 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.4 p . . . . . 0 N--CA 1.498 1.974 0 O-C-N 120.554 -1.341 . . . . 1.08 109.269 -179.64 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo . . . . . 0 N--CA 1.491 1.381 0 CA-C-O 121.372 0.488 . . . . 1.46 111.716 . . . . . . . . . 0 0 . 1 . 022 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.3 121.29 36.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.345 -0.847 . . . . 0.88 108.819 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 28.9 m -102.37 128.52 48.91 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.226 -0.921 . . . . 0.7 109.545 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 66.3 mt -69.37 -30.2 68.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.316 -0.865 . . . . 0.61 109.355 179.455 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt -62.31 -19.46 63.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.591 -0.693 . . . . 1.31 109.539 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.5 HD11 ' HA2' ' A' ' 91' ' ' GLY . 30.3 mm -131.72 141.86 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 121.672 -0.642 . . . . 0.15 109.527 -179.765 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -101.73 126.5 48.6 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 107.688 -1.227 . . . . 0.19 107.688 177.649 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -76.97 144.35 38.82 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.988 -1.07 . . . . 0.2 110.813 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.478 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.5 m95 -79.47 -17.04 55.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.334 -0.854 . . . . 0.21 109.44 179.409 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 44.6 m-20 -56.56 -11.13 1.17 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.868 -1.16 . . . . 0.49 107.868 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.506 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.7 p -64.96 143.98 15.25 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 N-CA-C 109.153 -0.684 . . . . 1.04 109.153 179.739 . . . . . . . . 2 2 . 1 . 022 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -60.15 -39.16 85.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 1.36 109.64 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear build full ' B' B ' 71' ' ' GLY . . . . . 0.506 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.49 2.27 0 CA-C-O 117.975 -1.458 . . . . 2.32 109.583 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.0 mmm . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 108.755 -0.832 . . . . 2.88 108.755 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.547 HG12 ' N ' ' A' ' 3' ' ' LYS . 79.3 t -98.7 163.91 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.198 -0.938 . . . . 0.45 109.327 -179.906 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.547 ' N ' HG12 ' A' ' 2' ' ' VAL . 18.4 tptp -129.45 128.69 43.43 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 107.787 -1.19 . . . . 1.67 107.787 179.848 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -96.13 121.97 38.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.16 -0.963 . . . . 0.31 108.882 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.2 mm -102.21 117.5 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 107.793 -1.188 . . . . 0.19 107.793 179.379 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.7 mp0 -99.38 -0.75 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.921 -1.112 . . . . 2.25 109.993 -178.879 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.83 158.11 38.91 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.973 -1.079 . . . . 0.15 110.942 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -63.1 -32.79 74.25 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.467 -0.938 . . . . 1.65 108.467 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.0 m -57.65 -47.89 81.0 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.114 -0.991 . . . . 0.23 108.811 -179.484 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.18 -31.15 70.49 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.253 -0.905 . . . . 0.17 108.694 178.551 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.427 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.0 t80 -59.4 -43.86 92.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.14 108.655 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -66.05 -41.81 90.33 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.912 -0.773 . . . . 1.31 108.912 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -65.52 -35.68 81.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 1.77 110.307 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.04 -41.35 77.78 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.13 -0.982 . . . . 0.15 109.268 -179.406 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.427 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.7 mt -61.09 -39.9 91.67 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.192 -0.943 . . . . 0.17 108.549 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.17 -35.39 76.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.651 -0.655 . . . . 1.07 109.999 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.54 -35.85 75.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.293 -0.88 . . . . 0.18 110.486 -179.142 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.63 75.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.082 -1.011 . . . . 0.17 109.867 -179.72 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.07 -126.11 22.75 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.882 -1.287 . . . . 0.2 109.882 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -90.96 3.48 54.53 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.035 -1.273 . . . . 1.07 110.269 -178.886 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mttt -75.4 150.43 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.858 -1.151 . . . . 1.5 109.111 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.685 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -60.76 159.07 11.58 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 107.244 -1.391 . . . . 0.47 107.244 179.573 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.677 ' H ' HD23 ' A' ' 22' ' ' LEU . 94.2 t -145.66 120.06 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.87 -1.144 . . . . 0.17 108.712 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.9 t -108.35 142.6 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 107.955 -1.128 . . . . 0.14 107.955 179.551 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.7 118.76 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.189 -0.944 . . . . 0.13 109.157 -179.273 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.555 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 31.8 t70 -97.33 120.31 37.45 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.36 -0.837 . . . . 1.05 109.852 179.082 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -96.7 24.06 6.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.237 -0.914 . . . . 0.73 110.024 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.8 m -57.48 141.94 45.87 Favored 'General case' 0 C--N 1.294 -1.812 0 O-C-N 121.233 -0.917 . . . . 0.3 110.55 -178.243 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.731 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -81.65 125.52 30.67 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.671 -1.233 . . . . 0.22 107.671 179.138 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.72 -33.34 74.7 Favored 'General case' 0 C--N 1.295 -1.796 0 C-N-CA 118.94 -1.104 . . . . 0.3 108.342 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.731 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.6 p-90 -70.48 -24.23 62.82 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.669 . . . . 0.26 110.902 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.93 123.11 29.62 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.565 -1.272 . . . . 0.26 107.565 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.462 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.58 -51.82 39.18 Favored Glycine 0 N--CA 1.489 2.179 0 C-N-CA 120.27 -0.967 . . . . 0.23 111.235 -178.087 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -53.44 -33.87 69.12 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 CA-C-N 118.524 1.162 . . . . 0.31 111.443 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.52 -53.98 7.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.471 -0.768 . . . . 0.24 110.166 -179.896 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -60.08 -36.94 78.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.061 -1.024 . . . . 1.59 109.76 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.498 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -60.15 -30.95 69.64 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.232 -0.917 . . . . 2.1 109.917 -179.11 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.587 HG22 ' O ' ' A' ' 38' ' ' ILE . 70.0 mt -81.38 -4.5 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.863 -0.523 . . . . 0.49 111.324 -179.335 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.1 ptmt -64.85 -28.79 3.05 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 120.558 -1.339 . . . . 0.8 113.567 -177.179 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.8 Cg_exo -55.62 -39.64 89.93 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 CA-C-N 121.952 1.733 . . . . 0.28 113.22 -176.316 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -68.14 -44.61 75.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.815 -1.554 . . . . 0.37 108.319 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.33 -54.82 41.06 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.409 -0.807 . . . . 0.16 110.405 178.815 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 43' ' ' HIS . . . . . 0.513 ' ND1' HG21 ' A' ' 2' ' ' VAL . 41.7 t60 -67.65 -41.14 84.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.494 -0.754 . . . . 0.32 110.939 -179.727 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 64.1 m -62.14 -36.48 81.93 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.0 -1.063 . . . . 0.22 110.91 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -63.87 -19.37 65.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.214 -0.929 . . . . 0.22 110.04 -178.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -53.05 -39.53 63.32 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.91 -1.144 . . . . 0.16 107.91 -179.533 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 35.5 mp0 -82.96 -16.41 47.43 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.375 -0.828 . . . . 2.16 109.397 179.154 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -76.91 -39.0 52.39 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.513 -1.292 . . . . 1.78 107.513 179.166 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -123.7 67.81 1.03 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.3 -1.37 . . . . 0.25 107.3 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.2 p -62.89 -9.08 8.42 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.876 -0.787 . . . . 0.22 108.876 -179.467 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -90.13 6.91 40.52 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.288 -1.004 . . . . 1.13 108.288 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.502 HG13 ' HB3' ' A' ' 22' ' ' LEU . 55.2 t -125.05 145.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.041 -1.096 . . . . 0.24 108.041 179.42 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.5 mm -99.96 122.83 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 120.956 -1.09 . . . . 0.15 109.476 -178.549 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.603 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.7 m-85 -102.95 126.95 50.33 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.12 109.992 179.731 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.603 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -111.32 139.98 46.27 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.128 -0.983 . . . . 0.22 109.717 178.861 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -110.2 130.11 55.6 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 107.086 -1.45 . . . . 1.13 107.086 178.124 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.2 t -127.76 136.25 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.401 -0.812 . . . . 0.15 110.533 -177.847 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.605 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.6 t0 -98.69 120.34 38.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.363 -0.836 . . . . 1.05 108.95 179.507 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -66.74 -18.25 23.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 120.479 -1.388 . . . . 0.16 108.209 179.36 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 18.8 m-20 -93.8 -44.0 8.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.279 -0.888 . . . . 1.08 111.545 -179.097 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.4 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 25.8 m-20 -93.95 -13.49 27.01 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.537 -1.352 . . . . 1.07 108.423 179.586 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -125.24 38.38 4.19 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.578 -1.267 . . . . 0.14 107.578 179.518 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -59.9 -23.85 63.82 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.854 -0.528 . . . . 1.47 109.882 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.612 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -66.49 -38.26 86.87 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.034 -1.041 . . . . 1.05 108.984 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.612 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.2 t -69.95 -43.96 78.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.308 -0.87 . . . . 0.35 109.573 179.868 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 -36.33 64.0 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.449 -0.782 . . . . 0.26 111.235 -178.595 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.2 p -60.12 -37.73 80.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.773 -1.204 . . . . 0.24 109.428 -179.41 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.25 -38.13 89.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 2.06 109.526 179.327 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.448 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.44 -3.63 58.91 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.448 -0.782 . . . . 0.23 110.313 -178.907 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mp0 54.74 49.61 17.6 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.373 -0.829 . . . . 2.02 109.232 -179.584 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.77 132.21 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 120.846 -1.159 . . . . 0.16 108.576 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -103.48 -11.92 17.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.582 -0.699 . . . . 1.6 110.813 -178.902 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.517 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.97 156.26 24.53 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.751 -1.218 . . . . 0.14 110.596 -179.442 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -128.5 153.36 79.31 Favored Pre-proline 0 N--CA 1.497 1.888 0 N-CA-C 107.455 -1.313 . . . . 0.15 107.455 178.139 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -76.85 140.47 65.27 Favored 'Cis proline' 0 N--CA 1.488 1.205 0 C-N-CA 123.617 -1.409 . . . . 0.16 112.405 -2.655 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.517 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.0 m -124.91 132.64 53.27 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.934 -1.136 . . . . 0.13 107.934 177.475 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.555 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.0 m-85 -111.13 132.02 54.63 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.444 -0.947 . . . . 0.2 108.444 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.448 HE22 ' HB1' ' A' ' 69' ' ' ALA . 83.4 mt-30 -122.23 143.12 49.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.275 -0.89 . . . . 0.29 108.612 179.463 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 100' ' ' THR . 88.2 m-85 -109.12 132.68 53.89 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.525 0.679 . . . . 0.14 110.581 -178.589 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -127.53 147.29 50.32 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.473 0.654 . . . . 0.15 109.341 179.194 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -148.9 126.35 11.6 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.74 -1.207 . . . . 1.68 107.74 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.3 mttp 59.86 28.42 17.91 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.518 -0.739 . . . . 1.22 109.072 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.89 19.95 71.72 Favored Glycine 0 N--CA 1.489 2.198 0 O-C-N 121.101 -0.999 . . . . 0.23 111.095 179.281 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 92.6 mt-30 -130.46 145.13 51.78 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.045 -1.268 . . . . 2.07 109.94 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -79.87 126.86 31.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.287 -0.883 . . . . 1.82 109.636 179.663 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.6 m -121.63 6.04 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.737 -0.602 . . . . 0.3 110.126 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.81 157.03 21.09 Favored Glycine 0 N--CA 1.494 2.51 0 C-N-CA 118.716 -1.707 . . . . 0.17 111.454 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.453 ' OE2' ' CG2' ' A' ' 76' ' ' THR . 2.3 tp10 -164.95 147.46 8.22 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.518 -0.919 . . . . 1.93 108.518 179.367 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.46 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 4.3 p90 -169.4 155.87 6.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.665 -0.814 . . . . 0.14 109.213 177.932 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.4 p -126.17 162.77 24.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.688 -0.633 . . . . 0.12 110.024 -179.015 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.492 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.65 140.29 5.83 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.06 -1.616 . . . . 0.12 109.06 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.464 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.26 64.09 2.0 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.286 -1.126 . . . . 0.18 110.537 -179.296 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.3 t-20 -118.85 100.0 7.11 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.376 -0.972 . . . . 0.88 108.376 178.018 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.76 -30.12 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.328 -0.857 . . . . 1.06 111.641 -179.107 . . . . . . . . 3 3 . 1 . 023 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -66.64 -29.85 69.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.875 -1.14 . . . . 1.61 109.76 -179.842 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 52.4 tttp -61.82 -33.92 75.01 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 109.043 -0.725 . . . . 1.45 109.043 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.48 -39.98 85.48 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.707 -0.849 . . . . 0.19 108.707 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.9 -43.96 97.38 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.232 -0.987 . . . . 2.1 110.854 -178.363 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.78 77.84 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.187 -0.946 . . . . 0.19 111.076 -178.362 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.4 HG21 ' CE1' ' A' ' 79' ' ' PHE . 19.6 m -64.74 -39.95 94.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.736 -1.228 . . . . 0.2 108.189 -179.104 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.429 ' O ' ' N ' ' A' ' 105' ' ' VAL . 74.1 mt -65.29 -47.13 88.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 107.671 -1.233 . . . . 0.16 107.671 178.397 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.479 ' O ' HG12 ' A' ' 105' ' ' VAL . 49.1 t30 -60.52 -35.47 76.06 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.657 -1.238 . . . . 0.95 107.657 179.562 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -69.98 -39.23 76.05 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 116.022 -0.535 . . . . 2.21 110.143 -179.33 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.685 ' HB2' HD11 ' A' ' 22' ' ' LEU . 84.6 mt -98.34 -4.45 34.92 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.061 -1.025 . . . . 0.25 111.398 -178.986 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.479 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.3 p . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.485 -1.385 . . . . 1.08 109.143 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo . . . . . 0 N--CA 1.492 1.399 0 CA-C-O 120.934 0.306 . . . . 1.46 112.334 . . . . . . . . . 0 0 . 1 . 023 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -105.58 122.58 46.32 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.214 -0.929 . . . . 0.88 109.397 179.327 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.483 HG22 ' H ' ' B' ' 63' ' ' LYS . 56.9 m -107.1 131.21 54.37 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.255 -0.903 . . . . 0.7 109.978 -179.4 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.2 mt -68.09 -30.21 69.33 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.269 -0.894 . . . . 0.61 109.929 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.483 ' H ' HG22 ' B' ' 61' ' ' THR . 42.2 mmtm -65.3 -16.97 64.13 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.134 -0.979 . . . . 1.31 109.578 -179.404 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.493 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 33.2 mm -130.42 142.49 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 121.855 -0.528 . . . . 0.15 109.721 -179.46 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 22.2 m -98.49 131.97 44.31 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 107.407 -1.331 . . . . 0.19 107.407 177.57 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.4 m -81.02 139.38 35.79 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.851 -1.155 . . . . 0.2 111.244 -178.2 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.472 ' C ' ' N ' ' B' ' 69' ' ' VAL . 22.9 m95 -77.19 -18.28 57.87 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.292 -0.88 . . . . 0.21 109.409 178.882 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 21.1 m-20 -54.11 -12.57 0.63 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.123 -1.066 . . . . 0.49 108.123 179.354 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.584 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.4 p -61.89 136.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 109.13 -0.693 . . . . 1.04 109.13 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.96 -28.23 69.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.01 -1.056 . . . . 1.36 109.909 -178.99 . . . . . . . . 1 1 . 1 . 023 nuclear build full ' B' B ' 71' ' ' GLY . . . . . 0.584 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 109.292 -1.523 . . . . 2.32 109.292 -179.732 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 ttm . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.141 -0.688 . . . . 2.88 109.141 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.3 t -98.88 152.8 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.231 -0.918 . . . . 0.45 109.553 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -129.94 123.97 31.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.432 -0.792 . . . . 1.67 109.205 179.924 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -93.37 125.16 37.82 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.742 -0.836 . . . . 0.31 108.742 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mm -99.86 113.59 35.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 N-CA-C 108.422 -0.955 . . . . 0.19 108.422 179.402 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -99.13 -1.04 40.42 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.116 -0.99 . . . . 2.25 109.915 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.3 p -155.38 154.51 32.09 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.108 -0.995 . . . . 0.15 110.999 -179.855 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 ttpp -61.49 -33.96 74.68 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.926 -1.138 . . . . 1.65 107.926 178.711 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 42.1 m -57.55 -44.12 84.95 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.32 -0.952 . . . . 0.23 108.555 -179.446 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.31 69.54 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.25 -0.906 . . . . 0.17 109.037 178.476 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.545 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.1 t80 -59.73 -43.2 94.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.257 -0.902 . . . . 0.14 109.028 -179.189 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -66.18 -40.52 90.53 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.688 -0.856 . . . . 1.31 108.688 179.467 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -64.64 -40.93 96.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.292 0.567 . . . . 1.77 110.562 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.9 -40.9 83.37 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.309 -0.869 . . . . 0.15 108.907 -178.972 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.545 HD11 ' CE2' ' A' ' 11' ' ' PHE . 58.0 mt -60.89 -40.03 91.5 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.343 -0.984 . . . . 0.17 108.343 179.197 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -69.99 -34.37 73.25 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.416 -0.803 . . . . 1.07 109.834 179.775 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.99 76.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.225 -0.922 . . . . 0.18 109.926 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.97 74.9 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 0.17 109.025 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.61 18.62 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.879 -1.288 . . . . 0.2 109.879 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -90.19 3.3 53.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.133 -1.216 . . . . 1.07 110.747 -179.053 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mtpt -77.06 149.99 35.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 1.5 109.51 -179.686 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.668 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.9 155.49 19.64 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.082 -1.081 . . . . 0.47 108.082 -179.39 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.668 ' H ' HD23 ' A' ' 22' ' ' LEU . 87.6 t -144.35 112.42 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.012 -1.055 . . . . 0.17 109.131 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -99.6 141.9 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.168 -1.049 . . . . 0.14 108.168 179.583 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.98 122.34 63.11 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.217 -0.927 . . . . 0.13 110.196 -178.542 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -99.24 122.94 43.09 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.646 -0.658 . . . . 1.05 109.775 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -99.26 18.54 17.33 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.264 -0.898 . . . . 0.73 109.925 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.5 m -52.05 147.87 6.82 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-O 122.063 0.935 . . . . 0.3 110.618 -178.791 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.803 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.76 123.9 31.66 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.444 -1.317 . . . . 0.22 107.444 178.743 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.77 -28.96 68.81 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.195 -1.002 . . . . 0.3 108.332 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.803 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 68.4 p-90 -78.02 -15.82 58.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.496 -0.753 . . . . 0.26 110.977 -179.515 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.7 t -88.22 116.55 26.5 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.877 -1.139 . . . . 0.26 108.04 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.42 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.37 -53.56 44.53 Favored Glycine 0 N--CA 1.489 2.193 0 C-N-CA 120.081 -1.057 . . . . 0.23 111.256 -178.521 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.99 -35.99 52.16 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.949 1.375 . . . . 0.31 111.612 179.895 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.92 -48.81 17.14 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.438 -0.789 . . . . 0.24 109.662 -179.908 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.04 -37.81 80.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 1.59 109.47 179.514 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 33.0 tpp -59.12 -27.48 65.64 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.517 -0.74 . . . . 2.1 109.27 -179.393 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 38' ' ' ILE . 96.6 mt -80.94 -4.08 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.971 -0.456 . . . . 0.49 111.368 -179.772 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.08 5.83 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 120.283 -1.51 . . . . 0.8 113.916 -178.028 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.536 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 30.5 Cg_exo -58.89 -41.42 62.47 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 121.675 1.634 . . . . 0.28 112.379 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 41' ' ' PHE . . . . . 0.634 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 35.4 m-85 -69.13 -50.21 50.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.693 -1.255 . . . . 0.37 109.547 179.513 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -59.96 -50.82 72.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.027 -1.045 . . . . 0.16 109.447 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -67.54 -40.01 85.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.891 -0.506 . . . . 0.32 110.69 -179.423 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -63.29 -39.22 93.97 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.957 -1.089 . . . . 0.22 111.085 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.01 -23.43 63.67 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.194 -0.941 . . . . 0.22 110.203 -178.212 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.2 m -52.0 -40.15 60.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 118.72 -1.192 . . . . 0.16 108.765 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -82.82 -16.68 46.77 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.454 -0.779 . . . . 2.16 109.366 179.303 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -75.68 -37.44 59.55 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 107.362 -1.347 . . . . 1.78 107.362 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -124.75 68.71 1.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.077 -1.453 . . . . 0.25 107.077 177.894 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.4 p -62.28 -9.73 8.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.727 -0.842 . . . . 0.22 108.727 -179.255 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -91.92 9.84 31.29 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.644 -0.872 . . . . 1.13 108.644 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.8 t -127.58 144.82 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 107.639 -1.245 . . . . 0.24 107.639 178.981 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' CD1' ' A' ' 55' ' ' LEU . 27.2 mm -99.99 122.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.269 -0.895 . . . . 0.15 109.599 -178.55 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.471 ' C ' HD12 ' A' ' 55' ' ' LEU . 48.0 m-85 -103.06 126.81 50.41 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 108.692 -0.855 . . . . 0.12 108.692 179.25 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.471 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.0 mp -110.0 142.11 41.86 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.19 -0.944 . . . . 0.22 109.134 179.803 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -110.68 130.68 55.51 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 106.778 -1.564 . . . . 1.13 106.778 178.073 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.73 131.9 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.436 -0.79 . . . . 0.15 110.113 -178.333 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 45.6 t0 -96.1 119.89 35.4 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.518 -0.739 . . . . 1.05 109.599 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -67.98 -14.91 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.42 -1.425 . . . . 0.16 108.658 179.438 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.546 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 14.1 m-20 -94.45 -44.07 8.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.425 -0.797 . . . . 1.08 111.353 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -96.75 -18.63 19.49 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 120.776 -1.202 . . . . 1.07 108.836 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -119.03 36.59 4.4 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.346 -1.353 . . . . 0.14 107.346 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.579 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.4 OUTLIER -60.16 -23.55 64.03 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.961 -0.563 . . . . 1.47 110.277 -178.905 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -67.09 -35.43 79.77 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.001 -1.062 . . . . 1.05 108.633 179.5 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.419 HG23 ' OD1' ' A' ' 64' ' ' ASP . 5.6 t -73.36 -43.95 55.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.501 -0.749 . . . . 0.35 109.158 179.376 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.27 -40.77 74.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.393 -0.817 . . . . 0.26 110.957 -178.819 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.7 p -61.81 -32.71 73.04 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.71 -1.244 . . . . 0.24 109.287 -179.636 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -62.95 -38.16 89.97 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.282 -0.886 . . . . 2.06 109.075 179.344 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.54 2.04 55.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.558 -0.714 . . . . 0.23 111.081 -178.806 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 54.39 49.89 17.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.888 -1.133 . . . . 2.02 109.935 179.866 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.2 t -64.8 132.57 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 120.801 -1.187 . . . . 0.16 109.224 -179.114 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.95 -14.03 16.12 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.812 . . . . 1.6 110.056 -179.351 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.0 157.49 21.0 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.881 -1.137 . . . . 0.14 111.031 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -128.79 155.46 79.29 Favored Pre-proline 0 N--CA 1.499 1.99 0 N-CA-C 107.326 -1.361 . . . . 0.15 107.326 178.543 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -76.26 139.98 63.26 Favored 'Cis proline' 0 N--CA 1.49 1.288 0 C-N-CA 123.667 -1.389 . . . . 0.16 112.263 -2.178 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 99.1 m -124.56 139.53 53.79 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.491 -0.929 . . . . 0.13 108.491 178.038 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.471 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 95.4 m-85 -115.66 130.2 56.77 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.724 -0.843 . . . . 0.2 108.724 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -123.45 141.86 51.58 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.577 -0.897 . . . . 0.29 108.577 179.342 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 59.2 m-85 -108.37 137.25 46.65 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.528 0.68 . . . . 0.14 110.333 -179.229 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -129.91 147.31 51.66 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.377 0.608 . . . . 0.15 109.44 179.229 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -148.05 124.31 10.87 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.253 -1.388 . . . . 1.68 107.253 179.371 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 59.83 29.42 18.98 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.136 -1.061 . . . . 1.22 108.136 -178.235 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.59 15.23 81.72 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.611 -1.396 . . . . 0.23 109.611 -179.39 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.8 mm100 -115.58 133.83 55.65 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.432 -1.04 . . . . 2.07 110.515 -179.222 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -78.68 124.38 28.13 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.27 -1.011 . . . . 1.82 108.27 178.217 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.7 m -123.93 9.14 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.558 -0.714 . . . . 0.3 110.968 -179.464 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.86 152.58 10.94 Favored Glycine 0 N--CA 1.498 2.816 0 C-N-CA 118.616 -1.754 . . . . 0.17 111.454 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -165.37 147.77 7.79 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.697 -0.884 . . . . 1.93 109.765 179.377 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -163.94 162.03 23.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 119.305 -0.958 . . . . 0.14 109.333 177.072 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -125.4 160.36 29.61 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.515 0.674 . . . . 0.12 109.551 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.493 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.03 141.02 5.95 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.907 -1.677 . . . . 0.12 108.907 179.747 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.426 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.15 66.31 2.28 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.256 -1.144 . . . . 0.18 109.168 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.1 t-20 -119.81 92.17 3.72 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.413 -0.804 . . . . 0.88 109.073 179.691 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.634 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.5 OUTLIER -68.08 -32.17 72.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.081 -1.012 . . . . 1.06 111.422 -179.791 . . . . . . . . 3 3 . 1 . 024 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -62.68 -30.13 71.17 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.81 -1.181 . . . . 1.61 109.075 -179.165 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -61.05 -35.66 77.53 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 109.115 -0.698 . . . . 1.45 109.115 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.68 -39.35 84.24 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-O 122.013 0.911 . . . . 0.19 108.892 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.09 -42.89 99.34 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.846 -0.742 . . . . 2.1 110.502 -177.769 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.97 -44.02 73.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.19 111.399 -178.998 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.9 m -66.3 -39.87 89.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.903 -1.123 . . . . 0.2 110.004 -178.499 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.68 -50.04 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.819 -1.178 . . . . 0.16 107.819 178.715 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.492 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.7 t-20 -60.01 -34.91 73.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.507 -0.923 . . . . 0.95 108.507 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -68.02 -40.04 83.02 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.581 -0.7 . . . . 2.21 110.368 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.666 ' HB2' HD11 ' A' ' 22' ' ' LEU . 92.2 mt -99.46 -2.03 37.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.32 -0.862 . . . . 0.25 111.451 -178.656 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 102' ' ' ASN . 7.7 p . . . . . 0 N--CA 1.498 1.965 0 O-C-N 120.568 -1.333 . . . . 1.08 109.298 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo . . . . . 0 N--CA 1.498 1.786 0 CA-C-O 121.239 0.433 . . . . 1.46 111.694 . . . . . . . . . 0 0 . 1 . 024 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.46 120.29 35.44 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.199 -0.938 . . . . 0.88 109.537 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.403 ' O ' ' O ' ' B' ' 64' ' ' ILE . 27.4 m -104.21 127.51 51.83 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.404 -0.81 . . . . 0.7 109.614 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.7 mt -68.31 -32.43 72.56 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.445 -0.785 . . . . 0.61 109.448 179.102 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -61.58 -19.75 62.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.421 -0.8 . . . . 1.31 109.614 -178.869 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.493 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.2 mm -131.9 142.06 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.776 -0.577 . . . . 0.15 109.89 -179.101 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 17.9 m -99.7 125.26 45.54 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.937 -1.505 . . . . 0.19 106.937 177.157 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 69.5 m -77.99 140.89 39.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.897 -1.127 . . . . 0.2 110.386 -178.415 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.447 ' C ' ' N ' ' B' ' 69' ' ' VAL . 22.1 m95 -75.06 -10.13 59.18 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.183 -0.948 . . . . 0.21 109.252 179.785 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 44.2 m-20 -51.51 -12.37 0.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.334 -0.854 . . . . 0.49 108.862 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.447 ' N ' ' C ' ' B' ' 67' ' ' TRP . 14.6 m -63.77 143.29 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.385 -0.822 . . . . 1.04 109.485 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -59.98 -37.19 78.93 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.131 -0.981 . . . . 1.36 109.127 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.992 0 N-CA-C 109.251 -1.539 . . . . 2.32 109.251 -179.811 . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.482 -0.562 . . . . 2.88 109.482 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.5 t -98.96 148.4 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.367 -0.833 . . . . 0.45 110.024 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -130.05 129.41 43.6 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 108.355 -0.98 . . . . 1.67 108.355 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -98.66 124.97 43.79 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.246 -0.909 . . . . 0.31 108.727 178.667 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.1 mm -103.38 113.28 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.551 -0.907 . . . . 0.19 108.551 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -98.26 0.0 44.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.316 -0.865 . . . . 2.25 110.04 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -151.63 155.42 38.35 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.042 -1.036 . . . . 0.15 111.217 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HZ2' ' HB3' ' A' ' 8' ' ' LYS . 9.8 ttpp -64.82 -31.87 73.3 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.491 -0.929 . . . . 1.65 108.491 178.321 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 93.5 m -57.44 -49.82 75.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.996 . . . . 0.23 109.465 -179.472 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.95 -29.58 67.84 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 119.416 -0.914 . . . . 0.17 108.863 179.015 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.487 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.1 t80 -59.78 -44.04 94.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.177 -0.952 . . . . 0.14 109.518 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -64.74 -43.08 94.5 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.542 -0.91 . . . . 1.31 108.542 -179.788 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.04 -37.5 87.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.762 -0.586 . . . . 1.77 110.171 179.468 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.48 -41.26 84.87 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.089 -1.007 . . . . 0.15 108.949 -179.089 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' A' ' 11' ' ' PHE . 82.4 mt -60.24 -39.85 88.17 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.188 -0.945 . . . . 0.17 108.828 179.239 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.55 -36.3 76.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.53 -0.731 . . . . 1.07 110.335 -179.555 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.39 -35.93 76.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.316 -0.865 . . . . 0.18 110.512 -178.725 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.35 -30.95 71.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.106 -0.996 . . . . 0.17 109.301 -179.697 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.22 -125.85 24.88 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.465 -1.454 . . . . 0.2 109.465 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -92.17 5.16 51.42 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.294 -1.121 . . . . 1.07 110.729 -179.304 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.69 148.88 40.16 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.79 -1.194 . . . . 1.5 108.947 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.69 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -59.82 159.82 8.42 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 106.638 -1.616 . . . . 0.47 106.638 -179.973 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.69 ' H ' HD23 ' A' ' 22' ' ' LEU . 78.8 t -147.35 111.06 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 120.75 -1.219 . . . . 0.17 108.937 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -101.34 144.16 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.255 -1.017 . . . . 0.14 108.255 179.526 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.2 t -126.66 121.66 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.333 -0.854 . . . . 0.13 109.52 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.7 t70 -99.28 119.94 38.74 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.284 -0.885 . . . . 1.05 110.051 179.499 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -95.52 21.96 7.62 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.145 -0.972 . . . . 0.73 109.645 178.92 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.81 147.86 18.05 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.818 -1.176 . . . . 0.3 110.305 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.501 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.56 126.59 34.58 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.174 -1.047 . . . . 0.22 108.174 179.422 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -67.91 -30.21 69.48 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.207 -0.997 . . . . 0.3 109.191 -179.462 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 59.2 p-90 -75.79 -18.06 59.64 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.076 -1.05 . . . . 0.26 110.15 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.0 t -83.8 121.64 27.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.979 -1.075 . . . . 0.26 108.402 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.39 -55.03 28.01 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 121.518 -0.739 . . . . 0.23 112.534 -178.005 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.8 Cg_endo -60.7 -29.93 89.35 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 119.412 1.606 . . . . 0.31 112.09 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.61 -49.76 20.41 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.118 -1.067 . . . . 0.24 108.118 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.37 -32.35 71.21 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.158 -1.053 . . . . 1.59 108.158 177.962 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -57.88 -28.04 63.82 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.007 -0.542 . . . . 2.1 110.112 -179.334 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.84 HD11 ' HB1' ' A' ' 92' ' ' ALA . 81.9 mt -85.25 -0.92 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.458 -0.776 . . . . 0.49 111.573 -178.926 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.74 -30.75 6.84 Favored Pre-proline 0 C--N 1.302 -1.497 0 O-C-N 120.263 -1.523 . . . . 0.8 113.045 -178.768 . . . . . . . . 3 3 . 1 . 025 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.7 Cg_exo -59.7 -44.21 33.04 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 121.542 1.586 . . . . 0.28 112.91 -178.124 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -69.54 -45.38 68.93 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 118.36 -1.336 . . . . 0.37 108.948 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -61.31 -52.29 65.32 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.988 -1.07 . . . . 0.16 109.701 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -68.07 -42.49 80.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.536 -0.727 . . . . 0.32 111.548 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.1 m -62.74 -39.87 95.46 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.882 -1.136 . . . . 0.22 110.79 -179.202 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.5 mt -61.32 -23.78 65.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.331 -0.856 . . . . 0.22 110.755 -178.338 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.8 m -54.27 -35.32 62.41 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.094 -1.004 . . . . 0.16 109.009 -178.89 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -88.3 -13.0 41.92 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.082 -1.011 . . . . 2.16 108.734 179.183 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -80.52 -37.51 31.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.445 -1.317 . . . . 1.78 107.445 178.408 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -121.9 68.2 0.92 Allowed 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.986 -1.487 . . . . 0.25 106.986 178.138 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.1 p -64.01 -9.71 17.49 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 108.492 -0.929 . . . . 0.22 108.492 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -90.47 7.73 37.42 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.312 -0.996 . . . . 1.13 108.312 178.805 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.476 HG13 ' HB3' ' A' ' 22' ' ' LEU . 45.7 t -127.23 143.32 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 107.415 -1.328 . . . . 0.24 107.415 178.819 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.1 mm -99.78 124.13 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.097 -1.002 . . . . 0.15 109.501 -178.516 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.565 ' C ' HD12 ' A' ' 55' ' ' LEU . 40.0 m-85 -104.15 127.31 51.74 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.333 -0.855 . . . . 0.12 109.503 179.188 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.565 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.6 mp -110.42 139.86 45.21 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.3 -0.875 . . . . 0.22 109.218 178.239 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -110.06 130.34 55.55 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 106.982 -1.488 . . . . 1.13 106.982 178.164 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.4 t -128.28 134.04 65.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.354 -0.841 . . . . 0.15 110.74 -177.834 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.0 t0 -95.86 119.43 34.34 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.011 -0.737 . . . . 1.05 109.011 179.45 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.23 -16.38 20.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.476 -1.39 . . . . 0.16 108.39 179.223 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.85 -41.47 9.62 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 1.08 111.261 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 25.6 m-20 -95.74 -22.2 17.68 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.844 -1.16 . . . . 1.07 108.747 179.81 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -118.46 39.92 3.34 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.866 -1.161 . . . . 0.14 107.866 179.534 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -60.08 -22.1 62.31 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.785 -0.572 . . . . 1.47 110.059 -178.469 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.587 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.701 -1.249 . . . . 1.05 109.196 179.665 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.587 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.5 t -73.68 -43.99 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.05 -1.031 . . . . 0.35 109.395 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.91 75.77 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.26 110.477 -178.743 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.8 p -60.77 -33.45 72.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.011 -1.056 . . . . 0.24 109.129 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -62.07 -39.87 93.87 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.406 -0.809 . . . . 2.06 109.438 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.414 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -88.76 1.34 55.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.313 -0.867 . . . . 0.23 111.162 -178.318 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 55.07 49.64 17.08 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.253 -0.905 . . . . 2.02 109.034 -179.291 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.78 130.7 28.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.41 -1.33 . . . . 0.16 107.41 -179.504 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -102.88 -12.12 17.76 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.624 -0.673 . . . . 1.6 109.998 -178.779 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.45 156.3 20.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.845 -1.159 . . . . 0.14 111.26 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.489 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.4 p -124.6 154.62 69.97 Favored Pre-proline 0 N--CA 1.499 2.01 0 N-CA-C 108.133 -1.062 . . . . 0.15 108.133 178.933 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -77.32 145.52 80.59 Favored 'Cis proline' 0 N--CA 1.492 1.406 0 C-N-CA 123.542 -1.441 . . . . 0.16 112.359 -3.115 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.41 131.1 48.47 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 108.564 -0.902 . . . . 0.13 108.564 178.125 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.799 ' CD1' HD21 ' A' ' 97' ' ' LEU . 89.8 m-85 -109.84 130.16 55.56 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.631 -0.668 . . . . 0.2 109.455 -179.207 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.414 HE22 ' CB ' ' A' ' 69' ' ' ALA . 72.2 mt-30 -120.63 140.45 51.54 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.41 -0.807 . . . . 0.29 109.04 179.104 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.9 131.97 53.95 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 121.117 0.484 . . . . 0.14 110.077 -179.341 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -124.84 145.83 49.58 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.492 0.663 . . . . 0.15 109.432 179.439 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -146.27 127.35 14.65 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.325 -1.361 . . . . 1.68 107.325 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.1 mttt 54.95 33.25 19.69 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.319 -0.863 . . . . 1.22 110.072 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.9 21.5 76.29 Favored Glycine 0 N--CA 1.491 2.312 0 O-C-N 120.913 -1.117 . . . . 0.23 110.921 178.899 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -131.02 141.51 50.23 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.209 -1.171 . . . . 2.07 109.786 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -77.67 126.84 31.49 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.98 -1.075 . . . . 1.82 109.51 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.0 m -122.25 12.1 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.766 -0.584 . . . . 0.3 110.187 -179.472 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.33 152.04 10.72 Favored Glycine 0 N--CA 1.493 2.447 0 C-N-CA 118.681 -1.723 . . . . 0.17 111.268 179.645 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.5 tp10 -163.04 137.49 6.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.819 -0.812 . . . . 1.93 109.451 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.483 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.2 p90 -163.37 158.82 21.68 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.591 -0.844 . . . . 0.14 109.976 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -125.97 161.66 27.0 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-O 121.326 0.584 . . . . 0.12 109.792 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.455 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.6 141.71 5.89 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.639 -1.384 . . . . 0.12 109.639 179.36 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.84 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.59 67.28 5.3 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.134 -1.216 . . . . 0.18 109.669 -179.932 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 99.01 6.36 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 108.684 -0.858 . . . . 0.88 108.684 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -35.03 75.26 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.157 -0.964 . . . . 1.06 111.479 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -64.13 -30.04 71.12 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.992 -1.067 . . . . 1.61 109.657 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.96 -37.4 82.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.693 -0.63 . . . . 1.45 109.612 -179.643 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.799 HD21 ' CD1' ' A' ' 77' ' ' PHE . 47.3 mt -58.77 -38.49 78.6 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.438 -0.949 . . . . 0.19 108.438 179.672 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -63.99 -40.68 96.91 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 120.252 -0.579 . . . . 2.1 110.748 -178.444 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.09 -43.92 73.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.082 -1.011 . . . . 0.19 111.651 -178.567 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.29 -40.01 93.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.759 -1.213 . . . . 0.2 109.923 -178.777 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.36 -51.63 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.255 -0.903 . . . . 0.16 108.982 -179.733 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.3 t30 -60.33 -34.24 73.54 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.334 -0.988 . . . . 0.95 108.334 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -68.05 -39.91 82.91 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.611 -0.681 . . . . 2.21 110.426 -178.823 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.561 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.8 mt -99.58 -1.98 36.82 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.284 -0.885 . . . . 0.25 110.971 -178.666 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.667 -1.271 . . . . 1.08 109.3 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo . . . . . 0 N--CA 1.494 1.547 0 CA-C-O 121.247 0.436 . . . . 1.46 112.114 . . . . . . . . . 0 0 . 1 . 025 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.3 124.2 33.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.228 -0.92 . . . . 0.88 108.924 179.229 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 24.3 m -108.39 130.2 55.23 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.462 -0.774 . . . . 0.7 109.124 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.42 -30.02 69.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.277 -0.889 . . . . 0.61 109.892 -179.742 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -59.32 -22.02 60.62 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.963 -0.754 . . . . 1.31 108.963 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.455 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.6 mm -128.41 140.34 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.558 -0.534 . . . . 0.15 109.558 -179.68 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.5 m -100.58 124.63 46.42 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 107.102 -1.444 . . . . 0.19 107.102 178.002 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -75.51 140.04 42.55 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.94 -1.1 . . . . 0.2 111.468 -177.873 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.489 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.8 m95 -75.42 -10.23 59.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.21 108.807 178.779 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 43.0 m-20 -51.28 -12.57 0.15 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.582 -0.895 . . . . 0.49 108.582 179.319 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.461 ' N ' ' C ' ' B' ' 67' ' ' TRP . 18.3 m -63.27 146.05 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.464 -0.773 . . . . 1.04 109.659 179.822 . . . . . . . . 2 2 . 1 . 025 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -60.28 -39.88 88.41 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.188 -0.945 . . . . 1.36 109.887 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 CA-C-O 118.101 -1.388 . . . . 2.32 109.724 -179.371 . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 mmt . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.475 -0.565 . . . . 2.88 109.475 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' A' A ' 2' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 3' ' ' LYS . 92.7 t -99.42 161.98 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.56 -0.712 . . . . 0.45 109.838 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 3' ' ' LYS . . . . . 0.544 ' N ' HG12 ' A' ' 2' ' ' VAL . 28.0 tptp -130.09 129.83 44.08 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 108.521 -0.918 . . . . 1.67 108.521 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -98.6 124.14 43.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.493 -0.755 . . . . 0.31 109.429 179.784 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.26 113.98 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 108.329 -0.989 . . . . 0.19 108.329 178.976 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -98.65 -0.52 42.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 2.25 109.689 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -155.25 157.89 37.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.057 -1.027 . . . . 0.15 110.948 179.782 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -65.16 -30.96 71.92 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.777 -1.194 . . . . 1.65 107.777 178.43 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.8 m -58.98 -47.36 85.44 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.327 -0.858 . . . . 0.23 108.941 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.1 -29.76 68.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.697 -0.853 . . . . 0.17 108.697 178.702 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.527 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.0 t80 -59.72 -44.78 93.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.227 -0.92 . . . . 0.14 109.259 -179.683 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -64.27 -43.65 94.19 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 121.809 0.814 . . . . 1.31 108.992 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.17 -37.36 87.12 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.341 0.591 . . . . 1.77 110.804 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.74 82.88 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.34 -0.85 . . . . 0.15 108.891 -179.373 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.527 HD11 ' CE2' ' A' ' 11' ' ' PHE . 63.3 mt -60.55 -40.2 90.71 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.352 -0.843 . . . . 0.17 108.791 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.26 -32.53 70.39 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.379 -0.825 . . . . 1.07 109.829 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.44 79.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.298 -0.876 . . . . 0.18 109.768 -179.078 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.83 76.36 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.17 109.317 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.89 -123.92 16.3 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.963 -1.255 . . . . 0.2 109.963 -179.734 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.42 2.3 54.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.971 -1.311 . . . . 1.07 110.589 -178.876 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -74.45 148.45 41.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.84 -1.162 . . . . 1.5 109.169 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.693 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -60.37 159.4 10.22 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.773 -1.566 . . . . 0.47 106.773 179.708 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.693 ' H ' HD23 ' A' ' 22' ' ' LEU . 88.7 t -146.93 113.49 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 120.78 -1.2 . . . . 0.17 108.983 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -101.35 141.75 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 107.964 -1.125 . . . . 0.14 107.964 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.0 t -124.58 120.62 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.397 -0.814 . . . . 0.13 109.377 -179.226 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.7 t70 -99.47 118.66 36.56 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.418 -0.801 . . . . 1.05 110.447 179.595 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -95.06 24.15 5.1 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.513 -0.742 . . . . 0.73 109.735 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.405 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.4 m -59.0 145.12 43.01 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.993 -1.067 . . . . 0.3 109.671 -178.835 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.734 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.33 124.04 31.5 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.462 -1.31 . . . . 0.22 107.462 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -67.84 -31.79 71.87 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.102 -1.073 . . . . 0.3 108.102 179.838 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.734 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.0 p-90 -70.54 -23.04 62.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.745 -0.597 . . . . 0.26 110.584 179.629 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -83.95 116.46 22.81 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.333 -1.358 . . . . 0.26 107.333 179.54 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.54 -50.83 63.55 Favored Glycine 0 N--CA 1.49 2.294 0 C-N-CA 120.514 -0.851 . . . . 0.23 111.503 -177.692 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.8 Cg_exo -54.56 -35.02 84.9 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 CA-C-N 118.518 1.159 . . . . 0.31 112.052 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.69 -47.85 16.14 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.835 . . . . 0.24 109.642 -179.83 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -60.12 -33.13 71.71 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.193 -1.04 . . . . 1.59 108.193 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.9 tpt -59.78 -30.17 68.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.837 -0.539 . . . . 2.1 109.725 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.557 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.5 mt -83.87 -2.04 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.705 -0.622 . . . . 0.49 110.88 -178.603 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.72 -30.81 7.56 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 120.423 -1.423 . . . . 0.8 113.028 -178.561 . . . . . . . . 3 3 . 1 . 026 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 24.4 Cg_exo -59.93 -42.17 47.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 CA-C-N 121.641 1.622 . . . . 0.28 112.826 -177.549 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -68.52 -45.98 70.79 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 118.628 -1.229 . . . . 0.37 108.767 -179.78 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -63.12 -51.97 64.4 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.977 -1.077 . . . . 0.16 109.572 179.002 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -67.46 -40.1 85.35 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.707 -0.62 . . . . 0.32 111.106 -179.444 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.8 m -63.88 -36.29 83.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.878 -1.139 . . . . 0.22 110.752 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.56 -20.82 65.95 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.212 -0.93 . . . . 0.22 110.656 -177.887 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.1 m -54.93 -36.46 65.29 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.917 -1.114 . . . . 0.16 108.632 -179.648 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.7 mp0 -88.18 -15.95 34.65 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.131 -0.98 . . . . 2.16 109.9 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -79.3 -37.42 37.76 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 107.169 -1.419 . . . . 1.78 107.169 179.147 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 49' ' ' TYR . . . . . 0.405 ' C ' ' H ' ' A' ' 51' ' ' ASN . 77.6 m-85 -123.77 67.01 1.03 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 107.374 -1.343 . . . . 0.25 107.374 178.169 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.6 p -63.35 -5.72 3.86 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.14 -1.059 . . . . 0.22 108.14 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.405 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.7 t-20 -79.99 -20.41 45.54 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.223 -0.658 . . . . 1.13 109.223 178.647 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 22' ' ' LEU . 60.8 t -107.01 149.46 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 108.774 -0.824 . . . . 0.24 108.774 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.8 mm -99.79 120.0 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.258 -0.901 . . . . 0.15 108.678 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.604 ' C ' HD12 ' A' ' 55' ' ' LEU . 44.2 m-85 -99.63 126.15 45.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.238 -0.914 . . . . 0.12 110.221 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.604 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -111.49 141.59 44.86 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.225 -0.922 . . . . 0.22 109.35 178.78 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -109.23 132.1 54.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 106.853 -1.536 . . . . 1.13 106.853 178.338 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.0 t -127.89 131.09 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.448 -0.782 . . . . 0.15 109.858 -178.052 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.685 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.5 t0 -94.27 120.31 34.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.436 -0.79 . . . . 1.05 108.898 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.0 m -67.46 -19.52 25.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 120.627 -1.296 . . . . 0.16 108.329 179.203 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.53 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 17.6 m-20 -92.03 -45.04 8.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.509 -0.744 . . . . 1.08 111.726 -179.271 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.448 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 18.1 m-20 -93.97 -13.59 26.87 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.566 -1.334 . . . . 1.07 108.195 179.553 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 36.98 4.51 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.734 -1.21 . . . . 0.14 107.734 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -60.03 -24.43 64.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.687 -0.633 . . . . 1.47 109.645 -178.803 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.538 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -66.67 -38.61 87.17 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.875 -1.141 . . . . 1.05 108.33 178.793 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.538 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.8 t -69.23 -44.54 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.395 -0.816 . . . . 0.35 109.626 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.56 -37.22 68.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.371 -0.831 . . . . 0.26 110.726 -178.664 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -60.24 -37.41 80.27 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.165 -0.959 . . . . 0.24 109.753 -178.785 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.07 -38.68 92.16 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.342 -0.849 . . . . 2.06 109.26 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 69' ' ' ALA . . . . . 0.408 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.74 -1.46 56.28 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.47 -0.769 . . . . 0.23 111.014 -178.816 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 53.84 48.29 21.66 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.027 -1.046 . . . . 2.02 109.596 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.8 t -63.22 134.37 28.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 C-N-CA 118.787 -1.165 . . . . 0.16 108.142 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -106.92 -12.3 15.5 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.563 -0.71 . . . . 1.6 109.797 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.471 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 154.53 19.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 0.14 110.911 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -127.62 154.5 77.69 Favored Pre-proline 0 N--CA 1.496 1.864 0 N-CA-C 107.726 -1.212 . . . . 0.15 107.726 178.611 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.6 143.25 73.75 Favored 'Cis proline' 0 N--CA 1.489 1.248 0 C-N-CA 123.57 -1.429 . . . . 0.16 112.569 -2.183 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.5 m -128.37 133.84 48.72 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.869 -0.789 . . . . 0.13 108.869 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.519 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.1 m-85 -110.71 131.02 55.41 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.632 -0.877 . . . . 0.2 108.632 -179.413 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 78' ' ' GLN . . . . . 0.408 HE22 ' HB1' ' A' ' 69' ' ' ALA . 72.3 mt-30 -122.47 140.19 53.02 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.533 -0.914 . . . . 0.29 108.533 179.429 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -106.63 132.94 52.05 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.377 0.608 . . . . 0.14 109.931 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -126.87 145.68 50.57 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 109.013 -0.736 . . . . 0.15 109.013 179.248 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -145.86 129.41 16.99 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 106.938 -1.505 . . . . 1.68 106.938 179.26 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.4 mttt 56.55 27.96 13.15 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.241 -0.912 . . . . 1.22 108.594 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.94 25.02 67.83 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.689 -1.364 . . . . 0.23 109.689 -179.75 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 39.9 mm-40 -128.69 136.18 50.26 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.394 -1.062 . . . . 2.07 110.362 -179.82 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -79.38 128.15 32.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.236 -0.915 . . . . 1.82 109.654 179.461 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.4 m -123.93 3.98 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.76 -0.587 . . . . 0.3 110.377 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.22 155.89 17.1 Favored Glycine 0 N--CA 1.496 2.639 0 C-N-CA 118.648 -1.739 . . . . 0.17 111.506 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -164.04 148.7 10.21 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.865 -0.785 . . . . 1.93 109.482 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 6.3 p90 -164.37 157.33 17.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.613 -0.835 . . . . 0.14 109.913 178.218 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.2 p -125.8 160.41 29.89 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.391 0.615 . . . . 0.12 109.673 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.481 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.01 141.7 5.84 Favored Glycine 0 N--CA 1.487 2.052 0 N-CA-C 109.125 -1.59 . . . . 0.12 109.125 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.457 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.01 65.76 2.1 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.378 -1.072 . . . . 0.18 109.57 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 46.0 t-20 -119.99 96.98 5.39 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.217 -0.927 . . . . 0.88 108.567 179.062 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -31.95 70.25 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.12 -0.988 . . . . 1.06 111.722 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.28 -29.85 70.93 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.793 -1.192 . . . . 1.61 108.914 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.04 -35.73 77.68 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.705 -0.622 . . . . 1.45 109.403 -179.434 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 56.3 mt -59.88 -39.86 86.76 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.136 0.97 . . . . 0.19 108.508 179.252 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -61.99 -43.76 98.16 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.755 -0.657 . . . . 2.1 111.087 -177.677 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.93 -44.1 73.74 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.035 -1.041 . . . . 0.19 111.659 -178.323 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -66.13 -40.2 90.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.87 -1.144 . . . . 0.2 110.165 -178.444 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.36 -50.11 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.036 -1.04 . . . . 0.16 108.548 179.351 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.461 ' O ' HG12 ' A' ' 105' ' ' VAL . 24.9 t-20 -59.94 -36.39 76.95 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.905 0.86 . . . . 0.95 108.846 179.209 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -67.72 -39.9 84.28 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.812 -0.555 . . . . 2.21 109.846 -178.644 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.687 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.8 mt -97.56 -4.53 37.58 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.152 -0.968 . . . . 0.25 111.267 -179.201 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.461 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.0 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 120.411 -1.431 . . . . 1.08 109.285 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.492 1.423 0 CA-C-O 121.081 0.367 . . . . 1.46 112.534 . . . . . . . . . 0 0 . 1 . 026 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.95 130.25 38.18 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.901 -1.124 . . . . 0.88 109.744 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.476 HG22 ' H ' ' B' ' 63' ' ' LYS . 22.7 m -105.75 131.81 52.64 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.541 -0.725 . . . . 0.7 109.71 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.65 -30.12 69.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.238 -0.914 . . . . 0.61 109.302 179.508 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.476 ' H ' HG22 ' B' ' 61' ' ' THR . 41.2 mmtm -61.22 -11.42 9.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.129 -0.693 . . . . 1.31 109.129 -179.486 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.481 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.1 mm -130.04 140.27 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 122.045 -0.409 . . . . 0.15 110.232 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 27.8 m -98.9 130.54 45.3 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 177.497 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 66' ' ' SER . . . . . 0.442 ' O ' HG12 ' B' ' 69' ' ' VAL . 54.1 m -81.25 144.79 31.31 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.721 -1.237 . . . . 0.2 110.875 -178.189 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.471 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.0 m95 -79.72 -15.49 57.42 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.236 -0.915 . . . . 0.21 109.53 178.727 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 39.3 m-20 -59.08 -10.98 3.03 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.465 -1.309 . . . . 0.49 107.465 179.126 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.536 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.6 p -64.79 141.44 18.22 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.093 -0.706 . . . . 1.04 109.093 179.922 . . . . . . . . 2 2 . 1 . 026 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -60.0 -37.33 79.38 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.282 -0.886 . . . . 1.36 109.205 -179.232 . . . . . . . . 1 1 . 1 . 026 nuclear build full ' B' B ' 71' ' ' GLY . . . . . 0.536 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.222 -1.551 . . . . 2.32 109.222 -179.891 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 mmt . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.26 0.553 . . . . 2.88 109.528 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.0 t -99.34 145.42 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.489 -0.757 . . . . 0.45 109.386 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -130.0 128.28 41.71 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.272 -0.893 . . . . 1.67 109.037 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -96.56 125.45 41.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.403 -0.811 . . . . 0.31 109.075 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 45.3 mm -100.32 111.26 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 N-CA-C 108.517 -0.92 . . . . 0.19 108.517 179.348 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 54.1 mp0 -98.88 -1.16 40.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.176 -0.952 . . . . 2.25 108.613 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -155.17 156.91 36.55 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.366 -0.834 . . . . 0.15 110.378 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' HZ1' ' HB2' ' A' ' 68' ' ' GLU . 15.4 ttmm -62.92 -33.37 75.2 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.195 -1.039 . . . . 1.65 108.195 178.509 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.0 m -53.59 -49.51 67.63 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.524 -0.87 . . . . 0.23 109.213 -178.55 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -30.48 69.37 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.334 -0.854 . . . . 0.17 109.165 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.526 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.0 t80 -58.49 -45.28 89.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.897 -1.127 . . . . 0.14 108.927 -179.478 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -64.88 -41.78 95.36 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.484 -0.76 . . . . 1.31 109.134 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.73 -39.72 94.12 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 1.77 110.819 -179.763 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.59 82.08 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.044 -1.035 . . . . 0.15 109.016 -179.31 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.526 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.6 mt -60.22 -41.71 93.65 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.938 -1.134 . . . . 0.17 107.938 179.165 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.49 -37.02 77.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.572 -0.705 . . . . 1.07 110.273 179.813 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.24 -39.64 82.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 0.18 110.429 -179.203 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.23 -27.91 69.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.91 . . . . 0.17 108.952 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.04 -126.36 28.78 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.625 -1.39 . . . . 0.2 109.625 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -90.69 4.52 51.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.118 -1.225 . . . . 1.07 110.059 -179.192 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 21' ' ' LYS . . . . . 0.413 ' HZ2' ' HG2' ' A' ' 21' ' ' LYS . 26.7 mtpp -74.75 150.52 39.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.873 -1.142 . . . . 1.5 109.079 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.653 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -59.62 159.5 8.41 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.511 -1.292 . . . . 0.47 107.511 -179.253 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.653 ' H ' HD23 ' A' ' 22' ' ' LEU . 61.8 t -147.25 116.89 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 120.993 -1.067 . . . . 0.17 108.3 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.31 144.01 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.211 -1.033 . . . . 0.14 108.211 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.4 t -125.24 123.78 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.38 -0.825 . . . . 0.13 109.938 -179.322 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -100.98 120.16 39.77 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.28 -0.888 . . . . 1.05 110.075 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -95.87 22.41 7.41 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.925 -1.109 . . . . 0.73 110.107 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -58.12 149.0 24.81 Favored 'General case' 0 C--N 1.296 -1.745 0 O-C-N 120.969 -1.082 . . . . 0.3 110.494 -178.057 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.596 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.59 124.18 31.85 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.963 -1.125 . . . . 0.22 107.963 179.389 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -65.18 -32.07 73.57 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 118.78 -1.168 . . . . 0.3 108.21 -179.795 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.596 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 51.9 p-90 -72.38 -24.37 61.25 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.326 -0.859 . . . . 0.26 111.495 179.672 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -82.8 116.65 22.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.584 -1.322 . . . . 0.26 109.304 -178.741 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.442 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.12 -51.98 54.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 111.267 -0.733 . . . . 0.23 111.267 -178.753 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.6 Cg_exo -50.98 -34.97 48.5 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 CA-C-N 118.776 1.288 . . . . 0.31 111.673 179.518 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.8 -47.45 15.17 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.39 -0.818 . . . . 0.24 109.637 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.74 -33.14 71.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.06 -1.025 . . . . 1.59 108.863 179.141 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 23.5 ttt -58.34 -26.21 62.84 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.516 -0.74 . . . . 2.1 109.969 179.366 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.489 HG22 ' O ' ' A' ' 38' ' ' ILE . 43.7 mt -86.27 -2.36 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.406 -0.809 . . . . 0.49 111.14 -178.705 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.553 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -63.38 -30.56 5.51 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 120.187 -1.571 . . . . 0.8 113.298 -177.533 . . . . . . . . 3 3 . 1 . 027 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 29.3 Cg_exo -60.15 -41.27 53.03 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 CA-C-N 121.492 1.569 . . . . 0.28 112.375 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -68.63 -48.52 63.86 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.797 -1.189 . . . . 0.37 109.534 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -60.91 -51.94 67.14 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.154 -0.967 . . . . 0.16 109.151 179.046 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -65.72 -43.31 89.48 Favored 'General case' 0 C--N 1.292 -1.892 0 O-C-N 121.691 -0.63 . . . . 0.32 110.747 179.634 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.5 m -62.77 -39.49 94.35 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.829 -1.169 . . . . 0.22 111.392 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.7 -20.06 63.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.97 -1.082 . . . . 0.22 110.159 -178.201 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.5 m -53.98 -39.71 66.26 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.974 -1.09 . . . . 0.16 108.284 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -83.07 -18.16 40.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.044 -1.035 . . . . 2.16 109.867 178.856 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -76.85 -35.69 57.34 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.244 -1.391 . . . . 1.78 107.244 179.597 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -123.8 67.11 1.03 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.405 -1.332 . . . . 0.25 107.405 178.183 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.3 p -64.28 -10.42 23.78 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 108.868 -0.79 . . . . 0.22 108.868 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -90.23 8.45 33.09 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.04 -1.096 . . . . 1.13 108.04 179.161 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 22' ' ' LEU . 40.3 t -127.16 143.65 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 107.483 -1.303 . . . . 0.24 107.483 178.598 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.405 HG22 ' CD1' ' A' ' 55' ' ' LEU . 27.7 mm -98.99 121.22 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.222 -0.924 . . . . 0.15 109.614 -178.375 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.447 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.3 m-85 -99.15 127.88 45.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.12 109.403 179.392 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.447 HD12 ' C ' ' A' ' 54' ' ' PHE . 2.8 mp -111.7 146.36 37.65 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.349 -0.845 . . . . 0.22 109.333 178.903 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -116.04 129.83 56.54 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.775 -1.565 . . . . 1.13 106.775 177.778 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.8 t -126.79 132.78 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 CA-C-O 121.547 0.689 . . . . 0.15 109.827 -178.359 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 53.7 t0 -97.98 118.92 35.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.535 -0.913 . . . . 1.05 108.535 179.626 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.2 m -65.57 -20.87 28.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 120.252 -1.53 . . . . 0.16 108.247 179.292 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.524 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 3.4 m-20 -92.14 -41.51 10.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.517 -0.739 . . . . 1.08 112.406 -177.982 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.424 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 65.6 m-20 -95.49 -20.98 18.61 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.402 -1.436 . . . . 1.07 108.437 179.223 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.98 43.42 2.79 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 108.238 -1.023 . . . . 0.14 108.238 179.258 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -61.56 -19.3 62.01 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.615 -0.678 . . . . 1.47 109.645 -179.144 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.651 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -62.8 -40.47 97.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.105 -0.997 . . . . 1.05 109.583 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.651 HG23 ' OD1' ' A' ' 64' ' ' ASP . 22.2 t -72.31 -43.45 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.244 -0.91 . . . . 0.35 109.69 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.49 -39.16 74.33 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.647 -0.658 . . . . 0.26 111.371 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -61.21 -36.0 78.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.983 -1.073 . . . . 0.24 109.191 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.467 ' HB2' ' HZ1' ' A' ' 8' ' ' LYS . 14.1 tm-20 -64.97 -39.67 93.84 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.527 -0.733 . . . . 2.06 109.24 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.15 -3.2 58.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.23 110.791 -178.987 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 55.51 50.31 14.88 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.002 -1.062 . . . . 2.02 109.746 -179.709 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.62 134.03 28.91 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 C-N-CA 118.627 -1.229 . . . . 0.16 108.63 -179.049 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -105.0 -12.72 16.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.67 -0.644 . . . . 1.6 110.23 -179.197 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.466 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 155.55 20.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.908 -1.12 . . . . 0.14 110.92 179.526 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.423 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.1 p -128.91 154.45 80.2 Favored Pre-proline 0 N--CA 1.499 1.983 0 N-CA-C 107.455 -1.313 . . . . 0.15 107.455 178.582 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -76.91 143.17 74.92 Favored 'Cis proline' 0 N--CA 1.492 1.43 0 C-N-CA 123.985 -1.256 . . . . 0.16 112.854 -1.565 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.0 m -130.0 134.75 47.63 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.044 -0.724 . . . . 0.13 109.044 178.55 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -110.58 130.16 55.63 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.378 0.608 . . . . 0.2 109.777 -179.385 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -120.98 139.94 52.58 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 108.189 -1.041 . . . . 0.29 108.189 179.29 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -105.84 134.97 48.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.669 -0.644 . . . . 0.14 110.126 -178.94 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -129.45 145.85 51.37 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.709 0.766 . . . . 0.15 109.577 179.266 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -149.09 131.18 15.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.372 -1.714 . . . . 1.68 106.372 179.072 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.6 mttt 57.33 30.08 17.92 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.186 -0.946 . . . . 1.22 109.575 -178.766 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.56 18.31 79.84 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.451 -1.06 . . . . 0.23 110.451 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -127.52 142.88 51.27 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.388 -1.066 . . . . 2.07 109.654 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -80.06 131.55 35.79 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.432 -0.792 . . . . 1.82 109.324 179.572 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.1 m -121.8 11.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.814 -0.554 . . . . 0.3 110.374 -179.638 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 167.49 161.54 17.18 Favored Glycine 0 N--CA 1.498 2.805 0 C-N-CA 118.42 -1.848 . . . . 0.17 112.012 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -165.32 149.23 8.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.872 -0.781 . . . . 1.93 110.198 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 12.1 p90 -162.84 160.59 25.3 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.078 -1.014 . . . . 0.14 109.135 177.876 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.29 164.9 20.0 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 121.492 0.663 . . . . 0.12 109.932 -178.914 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.483 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.74 142.38 6.68 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.072 -1.611 . . . . 0.12 109.072 179.862 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.409 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -78.78 62.96 3.41 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.272 -1.134 . . . . 0.18 109.495 -179.82 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 51.9 t-20 -116.72 97.37 5.94 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.475 -0.766 . . . . 0.88 109.015 179.398 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -32.66 72.4 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.332 -0.855 . . . . 1.06 111.265 -179.704 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.87 -30.04 71.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.044 -1.035 . . . . 1.61 109.934 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -61.23 -35.95 78.64 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.626 0.727 . . . . 1.45 109.206 -179.1 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.9 mt -59.52 -39.43 83.84 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 122.253 1.025 . . . . 0.19 108.968 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -62.43 -43.07 99.69 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 119.824 -0.75 . . . . 2.1 110.745 -177.797 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.15 69.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.951 -1.093 . . . . 0.19 111.031 -178.867 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.3 m -63.97 -40.16 95.77 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 0.2 109.874 -178.714 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.7 mt -61.29 -50.02 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 N-CA-C 107.849 -1.167 . . . . 0.16 107.849 178.784 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.471 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.2 t-20 -60.26 -35.08 74.68 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.693 -0.855 . . . . 0.95 108.693 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -67.65 -38.57 84.0 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.418 -0.801 . . . . 2.21 109.881 -178.639 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HB2' HD11 ' A' ' 22' ' ' LEU . 84.0 mt -99.21 -4.16 32.68 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.065 -1.022 . . . . 0.25 111.405 -179.463 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.471 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.496 1.868 0 O-C-N 120.538 -1.351 . . . . 1.08 109.164 -179.177 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo . . . . . 0 N--CA 1.493 1.494 0 CA-C-O 121.312 0.463 . . . . 1.46 112.204 . . . . . . . . . 0 0 . 1 . 027 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -90.8 125.46 35.72 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.205 -0.934 . . . . 0.88 109.387 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.439 HG22 ' H ' ' B' ' 63' ' ' LYS . 59.0 m -110.41 130.37 55.57 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.34 -0.85 . . . . 0.7 109.375 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.4 -32.19 73.69 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.153 -0.967 . . . . 0.61 109.949 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.439 ' H ' HG22 ' B' ' 61' ' ' THR . 63.7 mmtt -64.18 -19.99 65.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.215 -0.928 . . . . 1.31 109.536 -179.134 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.483 HD11 ' HA2' ' A' ' 91' ' ' GLY . 35.3 mm -130.28 139.88 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.856 -0.528 . . . . 0.15 110.404 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.6 m -98.17 125.38 43.17 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 107.524 -1.287 . . . . 0.19 107.524 177.334 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -77.93 145.07 36.34 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.831 -1.168 . . . . 0.2 111.689 -178.348 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.466 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.6 m95 -76.7 -12.02 59.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.805 . . . . 0.21 108.976 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 40.9 m-20 -51.34 -13.05 0.17 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.031 -1.043 . . . . 0.49 108.485 179.654 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.463 ' N ' ' C ' ' B' ' 67' ' ' TRP . 19.0 m -61.33 145.92 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.17 -0.957 . . . . 1.04 109.79 179.781 . . . . . . . . 2 2 . 1 . 027 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -61.01 -37.67 83.35 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.433 -0.792 . . . . 1.36 109.208 -179.423 . . . . . . . . 1 1 . 1 . 027 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.458 0 CA-C-O 117.897 -1.502 . . . . 2.32 109.842 -179.864 . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.736 -0.468 . . . . 2.88 109.736 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 69.8 t -97.99 153.71 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.373 -0.83 . . . . 0.45 109.465 -179.526 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -131.33 130.11 42.29 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.382 -0.823 . . . . 1.67 108.889 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -95.96 124.22 39.88 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.888 -1.132 . . . . 0.31 108.595 178.74 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.4 mm -102.0 112.03 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.341 -0.849 . . . . 0.19 109.329 179.57 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.48 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.1 mp0 -97.21 -1.0 45.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.946 . . . . 2.25 109.372 179.836 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -154.87 157.62 38.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.59 -1.319 . . . . 0.15 111.208 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.419 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 34.4 ttmt -63.88 -32.48 74.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.017 -1.105 . . . . 1.65 108.017 177.648 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.4 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 52.1 m -56.28 -46.43 79.74 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.319 -0.952 . . . . 0.23 108.841 -178.82 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.59 -30.25 66.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.256 -0.902 . . . . 0.17 109.166 178.745 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.51 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.8 t80 -59.86 -43.81 94.47 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.397 -0.815 . . . . 0.14 108.974 -179.025 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -65.55 -42.96 91.31 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.693 0.759 . . . . 1.31 109.819 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -66.52 -39.7 88.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.556 -0.715 . . . . 1.77 110.06 179.638 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.9 96.26 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.304 -0.872 . . . . 0.15 108.696 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.51 HD11 ' CE2' ' A' ' 11' ' ' PHE . 65.4 mt -59.92 -40.25 88.23 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.219 -0.926 . . . . 0.17 108.597 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -69.39 -36.33 76.68 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.181 -0.95 . . . . 1.07 110.009 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.6 -39.31 84.8 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.343 -0.848 . . . . 0.18 110.516 -178.887 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -32.45 70.96 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.228 -0.92 . . . . 0.17 108.966 -179.874 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.55 -124.02 17.59 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.968 -1.253 . . . . 0.2 109.968 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -93.43 5.31 52.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.32 -1.106 . . . . 1.07 110.505 -179.073 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -76.55 149.28 36.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.157 -0.964 . . . . 1.5 109.173 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.682 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -60.31 157.73 13.05 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 106.861 -1.533 . . . . 0.47 106.861 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.663 ' H ' HD23 ' A' ' 22' ' ' LEU . 99.5 t -143.95 112.39 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.049 -1.032 . . . . 0.17 108.685 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -100.17 144.68 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 108.443 -0.947 . . . . 0.14 108.443 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.416 ' CG1' HG21 ' A' ' 57' ' ' VAL . 21.4 t -126.4 121.09 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 O-C-N 121.273 -0.892 . . . . 0.13 109.796 -179.917 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.0 t70 -98.66 120.08 38.49 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.217 -0.927 . . . . 1.05 109.872 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -96.3 23.27 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.342 -0.849 . . . . 0.73 110.059 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.469 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.3 m -58.67 147.36 33.06 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.054 -1.029 . . . . 0.3 110.746 -178.788 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.555 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.76 125.57 32.68 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 107.94 -1.133 . . . . 0.22 107.94 178.669 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 30' ' ' THR . . . . . 0.401 HG22 ' OD1' ' A' ' 58' ' ' ASP . 8.9 t -67.98 -33.91 75.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 118.957 -1.097 . . . . 0.3 108.573 -179.887 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.555 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.0 p-90 -70.42 -23.93 62.83 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.322 -0.861 . . . . 0.26 110.387 179.396 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.46 119.83 24.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.599 -1.313 . . . . 0.26 107.486 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -64.7 -51.29 53.09 Favored Glycine 0 N--CA 1.49 2.243 0 C-N-CA 120.3 -0.952 . . . . 0.23 110.737 -178.152 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -51.8 -36.34 62.23 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 118.553 1.176 . . . . 0.31 112.504 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.469 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.46 -48.86 16.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.97 . . . . 0.24 109.883 179.918 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.6 -34.91 74.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.119 -0.988 . . . . 1.59 109.465 179.309 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -60.01 -28.95 68.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.568 -0.708 . . . . 2.1 109.955 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.547 HG22 ' O ' ' A' ' 38' ' ' ILE . 68.2 mt -83.31 -0.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.753 -0.592 . . . . 0.49 110.379 -178.939 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.66 -30.26 6.22 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 120.674 -1.266 . . . . 0.8 113.051 -179.047 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.9 Cg_exo -59.76 -42.9 41.95 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 CA-C-N 121.699 1.643 . . . . 0.28 113.333 -177.507 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -67.91 -47.87 67.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.432 -1.417 . . . . 0.37 108.561 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -59.84 -51.53 69.32 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.296 -0.878 . . . . 0.16 110.104 179.174 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -69.37 -44.42 71.57 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 121.801 -0.562 . . . . 0.32 111.092 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 61.1 m -61.39 -39.96 92.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.147 -0.971 . . . . 0.22 110.332 -179.263 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -59.59 -24.28 63.64 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.12 -0.987 . . . . 0.22 110.113 -178.801 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -51.83 -36.53 48.36 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 120.648 -1.283 . . . . 0.16 108.957 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.7 mp0 -86.14 -14.34 44.41 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.116 -0.99 . . . . 2.16 109.43 179.178 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -80.38 -34.24 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.064 -1.458 . . . . 1.78 107.064 178.049 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -124.79 64.25 1.12 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.372 -1.344 . . . . 0.25 107.372 177.767 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -61.52 -9.7 6.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.542 -0.724 . . . . 0.22 109.27 -179.271 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -91.6 9.83 30.58 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.336 -0.987 . . . . 1.13 108.336 179.216 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.52 HG13 ' HB3' ' A' ' 22' ' ' LEU . 47.8 t -127.39 142.11 44.49 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 N-CA-C 106.683 -1.599 . . . . 0.24 106.683 178.575 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -99.79 119.61 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.053 -1.029 . . . . 0.15 109.425 -178.424 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.524 ' C ' HD12 ' A' ' 55' ' ' LEU . 30.0 m-85 -99.07 124.43 44.07 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.309 -0.87 . . . . 0.12 110.293 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.524 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.7 mp -109.16 141.43 41.38 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.168 -0.958 . . . . 0.22 109.095 178.855 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -110.02 132.35 54.24 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 106.925 -1.509 . . . . 1.13 106.925 178.101 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.416 HG21 ' CG1' ' A' ' 25' ' ' VAL . 40.9 t -128.38 132.54 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.476 -0.765 . . . . 0.15 110.416 -177.894 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 27.8 t0 -95.81 119.6 34.58 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.458 -0.776 . . . . 1.05 109.044 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.59 -16.57 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.469 -1.394 . . . . 0.16 108.598 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.6 m-20 -92.11 -42.91 9.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.449 -0.782 . . . . 1.08 111.506 -178.656 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -97.32 -23.4 16.14 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.869 -1.144 . . . . 1.07 108.638 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -114.08 36.36 3.74 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.828 -1.545 . . . . 0.14 106.828 179.191 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 63' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.3 OUTLIER -59.67 -20.53 56.85 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.657 -0.702 . . . . 1.47 110.037 -178.736 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.651 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -67.13 -37.43 83.84 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.98 -1.075 . . . . 1.05 109.201 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.651 HG23 ' OD1' ' A' ' 64' ' ' ASP . 19.0 t -72.89 -43.54 59.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.212 -0.93 . . . . 0.35 109.279 179.91 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.77 -40.04 72.87 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.71 -0.619 . . . . 0.26 110.849 -178.464 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.2 p -60.98 -35.41 76.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.514 -1.366 . . . . 0.24 108.864 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.419 ' OE2' ' NZ ' ' A' ' 8' ' ' LYS . 36.9 tt0 -62.22 -39.59 93.29 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.448 -0.782 . . . . 2.06 109.401 178.796 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.74 -2.56 58.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.28 -0.887 . . . . 0.23 110.767 -179.299 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 55.57 49.16 17.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.214 -0.929 . . . . 2.02 109.133 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.1 t -62.74 131.83 28.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 C-N-CA 118.267 -1.373 . . . . 0.16 108.397 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -102.85 -12.42 17.57 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.668 -0.645 . . . . 1.6 109.828 -178.983 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.467 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.22 155.93 18.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.704 -1.247 . . . . 0.14 110.588 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -128.47 153.77 79.28 Favored Pre-proline 0 N--CA 1.5 2.071 0 N-CA-C 107.796 -1.187 . . . . 0.15 107.796 178.642 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -76.51 141.07 68.82 Favored 'Cis proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.797 -1.335 . . . . 0.16 113.331 -2.115 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.467 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.2 m -125.72 135.16 51.77 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 108.246 -1.02 . . . . 0.13 108.246 177.918 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.749 ' CD2' HD21 ' A' ' 97' ' ' LEU . 89.7 m-85 -111.21 132.48 54.29 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.801 -0.815 . . . . 0.2 108.801 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -123.35 141.86 51.55 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.134 -0.979 . . . . 0.29 108.696 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 100' ' ' THR . 90.1 m-85 -109.02 131.45 55.06 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.588 0.709 . . . . 0.14 111.19 -178.504 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -126.57 145.66 50.45 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.395 0.617 . . . . 0.15 109.511 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -147.98 130.39 15.73 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.368 -1.345 . . . . 1.68 107.368 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.3 mttt 57.45 29.45 17.02 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.223 -0.923 . . . . 1.22 108.841 -178.893 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.66 18.23 79.17 Favored Glycine 0 N--CA 1.49 2.248 0 C-N-CA 120.026 -1.083 . . . . 0.23 110.557 179.811 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -126.82 140.75 52.13 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.185 -1.185 . . . . 2.07 110.467 179.907 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -79.64 129.73 34.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.412 -0.805 . . . . 1.82 108.869 179.198 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.5 m -125.43 3.91 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.588 -0.695 . . . . 0.3 110.187 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.89 156.97 20.05 Favored Glycine 0 N--CA 1.496 2.634 0 C-N-CA 118.108 -1.996 . . . . 0.17 111.984 -179.477 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -165.99 149.62 7.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.977 -0.719 . . . . 1.93 109.719 179.11 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.432 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 17.6 p90 -164.1 160.85 22.01 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.186 -1.005 . . . . 0.14 109.404 177.447 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -126.02 160.75 29.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.647 -0.658 . . . . 0.12 109.901 -179.614 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.493 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 120.91 138.89 5.61 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 108.931 -1.668 . . . . 0.12 108.931 179.885 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.543 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -77.71 65.5 3.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.214 -1.168 . . . . 0.18 110.711 -178.889 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.2 t-20 -118.03 101.66 8.43 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.273 -1.01 . . . . 0.88 108.273 178.109 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' H ' ' HD3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.4 -33.2 72.66 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.332 -0.855 . . . . 1.06 111.3 -179.398 . . . . . . . . 3 3 . 1 . 028 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.8 -29.92 71.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.868 -1.145 . . . . 1.61 109.575 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.436 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 79.2 tttt -62.79 -33.99 76.35 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.637 -0.665 . . . . 1.45 109.392 -179.097 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.749 HD21 ' CD2' ' A' ' 77' ' ' PHE . 39.7 mt -59.86 -39.91 86.83 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.53 -0.915 . . . . 0.19 108.53 179.733 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.05 -42.44 99.72 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.428 -0.909 . . . . 2.1 110.523 -178.451 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.38 77.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.949 -1.094 . . . . 0.19 111.123 -178.412 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.4 HG21 ' CE1' ' A' ' 79' ' ' PHE . 24.5 m -65.98 -39.93 90.76 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.61 -1.306 . . . . 0.2 108.599 -179.822 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.01 -47.0 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.396 -1.335 . . . . 0.16 107.396 177.923 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.488 ' O ' HG12 ' A' ' 105' ' ' VAL . 48.9 t30 -60.74 -36.77 79.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.504 -0.924 . . . . 0.95 108.504 179.047 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.27 -39.72 82.07 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.759 -0.588 . . . . 2.21 109.878 -179.174 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.682 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.1 mt -98.33 -2.75 38.65 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.429 -0.794 . . . . 0.25 111.661 -178.632 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.499 1.978 0 O-C-N 120.535 -1.353 . . . . 1.08 109.391 -179.119 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo . . . . . 0 N--CA 1.495 1.562 0 CA-C-O 121.047 0.353 . . . . 1.46 112.3 . . . . . . . . . 0 0 . 1 . 028 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.62 124.04 31.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.053 -1.029 . . . . 0.88 108.777 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 26.9 m -106.12 129.98 54.1 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.478 -0.764 . . . . 0.7 109.225 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.87 -30.11 70.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.373 -0.829 . . . . 0.61 109.67 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.48 -20.32 63.02 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.428 -0.795 . . . . 1.31 109.688 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.493 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.4 mm -129.88 140.19 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 121.583 -0.698 . . . . 0.15 109.463 -179.776 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 26.8 m -96.38 127.08 42.05 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 106.896 -1.52 . . . . 0.19 106.896 177.853 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.7 m -76.89 141.14 40.68 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.958 -1.089 . . . . 0.2 111.123 -178.042 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.7 m95 -77.18 -11.87 59.87 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.009 -1.057 . . . . 0.21 109.32 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 30.3 m-20 -54.22 -10.94 0.42 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.636 -0.876 . . . . 0.49 108.636 179.583 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.443 ' N ' ' C ' ' B' ' 67' ' ' TRP . 19.2 m -65.35 144.13 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.483 -0.761 . . . . 1.04 109.27 179.678 . . . . . . . . 2 2 . 1 . 028 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.45 -39.19 82.79 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.126 -0.984 . . . . 1.36 109.084 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.079 -1.608 . . . . 2.32 109.079 -179.426 . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mmm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 108.887 -0.782 . . . . 2.88 108.887 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 79.5 t -99.24 144.3 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.267 -0.896 . . . . 0.45 109.544 -179.833 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 tppt? -129.94 129.17 43.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.414 -0.958 . . . . 1.67 108.414 -179.721 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -98.95 123.07 42.98 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.659 -0.867 . . . . 0.31 108.659 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.6 mm -100.81 114.16 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.761 -0.829 . . . . 0.19 108.761 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.496 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.0 mp0 -97.22 -0.12 47.29 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.241 -0.912 . . . . 2.25 109.751 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.22 156.28 38.21 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.812 -1.18 . . . . 0.15 111.271 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -64.67 -30.92 71.95 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.13 -1.063 . . . . 1.65 108.13 178.323 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -58.21 -49.43 77.09 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.612 -0.835 . . . . 0.23 108.863 -179.246 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -29.48 67.65 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.43 -0.794 . . . . 0.17 109.079 178.994 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.456 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.6 t80 -59.71 -44.15 93.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.202 -0.936 . . . . 0.14 109.136 -179.834 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -66.93 -42.94 84.47 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.778 -0.769 . . . . 1.31 108.932 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -64.13 -36.55 84.42 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.519 -0.738 . . . . 1.77 110.352 179.569 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.03 -42.83 79.99 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.375 -0.828 . . . . 0.15 109.061 -179.36 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.456 HD11 ' CE2' ' A' ' 11' ' ' PHE . 80.3 mt -60.86 -39.99 91.22 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -0.876 . . . . 0.17 108.662 179.612 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -69.7 -36.4 75.91 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.425 -0.797 . . . . 1.07 109.632 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.16 -36.82 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.435 -0.791 . . . . 0.18 110.269 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.03 -27.53 69.47 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.139 -0.975 . . . . 0.17 109.534 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.29 -129.47 28.74 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.861 -1.295 . . . . 0.2 109.861 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -93.09 7.53 43.8 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.284 -1.127 . . . . 1.07 110.473 -179.112 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -75.6 149.92 38.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.018 -1.051 . . . . 1.5 109.453 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.65 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.08 153.92 20.57 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 107.216 -1.402 . . . . 0.47 107.216 179.73 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.65 ' H ' HD23 ' A' ' 22' ' ' LEU . 63.8 t -143.29 117.38 3.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 121.002 -1.061 . . . . 0.17 108.531 179.954 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.36 139.27 25.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 108.055 -1.091 . . . . 0.14 108.055 179.573 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.5 t -121.68 123.16 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.401 -0.812 . . . . 0.13 108.941 -179.783 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.545 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.9 t70 -102.75 110.01 21.79 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.649 -0.657 . . . . 1.05 110.924 -179.521 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -90.1 103.79 16.43 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.748 -1.575 . . . . 0.73 106.748 176.923 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.8 m -130.02 146.97 51.72 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.705 -0.85 . . . . 0.3 108.705 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.706 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.48 121.6 28.41 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.571 -1.27 . . . . 0.22 107.571 179.259 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -65.69 -32.36 73.88 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 118.514 -1.274 . . . . 0.3 107.618 179.801 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.706 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.4 p-90 -70.27 -25.75 63.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.513 -0.742 . . . . 0.26 110.809 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.42 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 5.9 t -83.12 116.85 22.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.812 -1.18 . . . . 0.26 108.458 -179.318 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.453 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.67 -52.0 55.18 Favored Glycine 0 N--CA 1.49 2.262 0 C-N-CA 120.724 -0.75 . . . . 0.23 111.45 -178.425 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -53.23 -33.19 63.87 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 CA-C-N 118.497 1.148 . . . . 0.31 112.183 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.08 -52.76 8.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.208 -0.932 . . . . 0.24 109.865 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -60.13 -36.73 78.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.03 -1.044 . . . . 1.59 109.611 179.645 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 36.7 tpp -59.65 -28.1 66.94 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.457 -0.777 . . . . 2.1 109.914 -179.49 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.57 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.9 mt -80.22 -4.01 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.49 110.781 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.02 -29.94 6.14 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.371 -1.456 . . . . 0.8 114.47 -177.711 . . . . . . . . 3 3 . 1 . 029 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 39.5 Cg_exo -59.22 -40.55 68.04 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 CA-C-N 122.039 1.764 . . . . 0.28 113.506 -177.452 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -68.1 -47.22 68.8 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 118.295 -1.362 . . . . 0.37 108.74 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.64 -50.77 69.91 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.391 -0.818 . . . . 0.16 109.73 179.126 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -66.77 -41.33 87.9 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.602 -0.686 . . . . 0.32 110.441 -179.517 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.2 m -63.03 -37.73 88.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.236 -0.915 . . . . 0.22 110.652 -179.859 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.07 -25.72 67.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.174 -0.953 . . . . 0.22 110.285 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.6 m -51.44 -39.45 57.4 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.981 -1.075 . . . . 0.16 108.577 -179.359 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -84.48 -16.72 41.49 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.469 -0.769 . . . . 2.16 109.366 179.955 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -78.89 -36.62 41.82 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.776 -1.202 . . . . 1.78 108.179 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.96 66.17 1.04 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.008 -1.479 . . . . 0.25 107.008 177.728 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.5 p -61.78 -9.71 7.19 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.279 -0.637 . . . . 0.22 109.279 -179.105 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -89.93 9.1 29.04 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.271 -1.011 . . . . 1.13 108.271 179.044 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.8 t -127.37 144.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 107.688 -1.227 . . . . 0.24 107.688 178.739 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.3 mm -99.92 122.76 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 120.99 -1.068 . . . . 0.15 109.594 -178.152 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.605 ' C ' HD12 ' A' ' 55' ' ' LEU . 50.5 m-85 -104.21 124.87 49.89 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.175 -0.953 . . . . 0.12 110.203 -179.813 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.605 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -111.31 140.34 45.96 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.071 -1.018 . . . . 0.22 109.903 178.804 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -110.48 132.01 54.55 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.019 -1.474 . . . . 1.13 107.019 177.84 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 64.7 t -125.63 136.08 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.464 -0.772 . . . . 0.15 110.847 -177.977 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.547 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.1 t0 -97.04 118.85 34.38 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.396 -0.965 . . . . 1.05 108.396 179.332 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.6 m -68.03 -19.21 24.5 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 O-C-N 120.568 -1.333 . . . . 0.16 108.723 179.56 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.434 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 4.7 m-20 -93.68 -42.36 9.21 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.432 -0.793 . . . . 1.08 111.736 -179.232 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.426 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 52.8 m-20 -94.13 -15.77 24.38 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.574 -1.329 . . . . 1.07 108.489 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.42 4.2 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.505 -1.295 . . . . 0.14 107.505 179.228 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -59.95 -20.21 56.26 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.376 -0.602 . . . . 1.47 109.376 -178.982 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.679 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -63.94 -39.12 93.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.153 -0.967 . . . . 1.05 109.156 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.679 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.8 t -73.39 -43.22 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.196 -0.94 . . . . 0.35 108.992 179.634 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.57 -40.05 80.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.528 -0.733 . . . . 0.26 110.935 -178.658 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.5 p -60.07 -37.6 80.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.797 -1.189 . . . . 0.24 108.556 -179.75 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.93 -36.1 82.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.502 -0.749 . . . . 2.06 109.143 178.8 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.94 -2.18 58.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.293 -0.879 . . . . 0.23 111.217 -178.858 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 52.72 49.95 19.19 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.775 -1.203 . . . . 2.02 109.776 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.3 t -64.94 131.99 30.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 C-N-CA 118.826 -1.15 . . . . 0.16 108.534 -179.413 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -104.29 -12.78 16.43 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.694 -0.629 . . . . 1.6 109.73 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.63 155.8 17.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.996 -1.065 . . . . 0.14 110.526 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.0 154.25 81.18 Favored Pre-proline 0 N--CA 1.501 2.112 0 N-CA-C 108.065 -1.087 . . . . 0.15 108.065 178.582 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -76.0 143.92 78.16 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.987 -1.255 . . . . 0.16 112.852 -2.857 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.6 m -128.68 135.9 49.9 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 108.493 -0.929 . . . . 0.13 108.493 178.828 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.818 ' CD2' HD21 ' A' ' 97' ' ' LEU . 87.5 m-85 -108.25 129.7 55.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.2 109.187 -179.075 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.3 136.17 54.86 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.164 -1.05 . . . . 0.29 108.164 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -104.57 134.83 47.09 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.417 0.627 . . . . 0.14 110.363 -179.025 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.93 148.95 48.1 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.621 0.724 . . . . 0.15 109.3 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -146.54 122.97 11.02 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.049 -1.463 . . . . 1.68 107.049 179.679 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 74.4 mttt 58.05 27.27 14.63 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.904 -1.147 . . . . 1.22 107.904 -178.403 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.49 11.04 84.58 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.515 -1.034 . . . . 0.23 110.515 -179.96 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.2 mm100 -112.63 134.52 54.11 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.413 -1.051 . . . . 2.07 109.919 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -79.31 123.91 27.9 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.996 -1.113 . . . . 1.82 107.996 178.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.4 m -124.79 12.12 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.809 -0.557 . . . . 0.3 110.452 -179.197 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.41 152.44 11.07 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 118.685 -1.721 . . . . 0.17 111.496 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -167.26 148.89 5.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.723 -0.869 . . . . 1.93 109.87 179.254 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.685 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 21.9 p90 -164.02 162.59 23.25 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 119.652 -0.819 . . . . 0.14 109.127 177.209 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -125.38 160.51 29.2 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 121.609 0.719 . . . . 0.12 110.329 -179.014 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.486 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 118.61 140.06 6.27 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.47 -1.452 . . . . 0.12 109.47 179.684 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.29 66.95 3.99 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.372 -1.075 . . . . 0.18 111.042 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.3 t-20 -116.98 96.88 5.66 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 106.919 -1.512 . . . . 0.88 106.919 177.861 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -37.49 77.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.565 -0.709 . . . . 1.06 112.705 -177.783 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -63.08 -28.86 70.37 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.888 -1.133 . . . . 1.61 109.572 -179.768 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.685 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 21.0 ttpp -63.93 -33.76 76.44 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.584 -0.698 . . . . 1.45 109.682 -179.032 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.818 HD21 ' CD2' ' A' ' 77' ' ' PHE . 34.2 mt -57.96 -38.91 76.89 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.985 -1.117 . . . . 0.19 107.985 179.036 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -60.47 -42.13 95.61 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 115.629 -0.714 . . . . 2.1 110.014 -178.673 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.08 77.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.182 -0.948 . . . . 0.19 110.958 -179.239 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.34 -39.89 89.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.924 -1.11 . . . . 0.2 109.309 -179.158 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.5 mt -60.91 -49.65 83.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 107.758 -1.201 . . . . 0.16 107.758 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.474 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.0 t-20 -60.06 -35.42 75.1 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.806 0.813 . . . . 0.95 109.024 178.934 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -67.57 -40.0 84.88 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.523 -0.735 . . . . 2.21 109.986 -178.407 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.563 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.3 mt -100.16 1.08 41.71 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.224 -0.923 . . . . 0.25 111.605 -178.756 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.468 -1.395 . . . . 1.08 109.87 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo . . . . . 0 N--CA 1.494 1.538 0 CA-C-O 121.074 0.364 . . . . 1.46 112.38 . . . . . . . . . 0 0 . 1 . 029 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -97.02 122.07 39.61 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.125 -0.984 . . . . 0.88 109.837 -179.552 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.458 HG22 ' H ' ' B' ' 63' ' ' LYS . 25.4 m -109.07 130.02 55.47 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.563 -0.711 . . . . 0.7 109.545 -179.783 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 67.1 mt -63.83 -29.76 70.92 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.088 -1.008 . . . . 0.61 109.567 179.821 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.458 ' H ' HG22 ' B' ' 61' ' ' THR . 30.3 mmtp -67.8 -15.87 63.84 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.418 -0.801 . . . . 1.31 109.609 -179.27 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.486 HD11 ' HA2' ' A' ' 91' ' ' GLY . 24.2 mm -129.96 140.49 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 O-C-N 121.765 -0.584 . . . . 0.15 110.065 -179.059 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.9 m -93.24 128.1 39.09 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.309 -1.367 . . . . 0.19 107.309 177.431 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -80.28 137.13 36.56 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.043 -1.036 . . . . 0.2 111.211 -178.287 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.515 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.6 m95 -73.59 -10.31 59.58 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.091 -1.006 . . . . 0.21 109.309 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 68' ' ' ASN . . . . . 0.408 ' O ' ' C ' ' B' ' 69' ' ' VAL . 24.9 m-20 -54.31 -5.04 0.07 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.596 -0.69 . . . . 0.49 109.355 179.666 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.515 ' H ' ' C ' ' B' ' 67' ' ' TRP . 3.3 t -40.57 138.54 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.515 -0.741 . . . . 1.04 109.867 -179.157 . . . . . . . . 2 2 . 1 . 029 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -60.12 -37.31 79.65 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.356 -0.84 . . . . 1.36 108.959 -179.638 . . . . . . . . 1 1 . 1 . 029 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 CA-C-O 117.963 -1.465 . . . . 2.32 109.519 -179.821 . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mmt . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 108.874 -0.788 . . . . 2.88 108.874 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.7 t -98.94 134.89 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.245 -0.909 . . . . 0.45 109.469 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -128.79 129.26 45.42 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.174 -1.047 . . . . 1.67 108.174 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 4' ' ' GLN . . . . . 0.467 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 64.4 tt0 -97.77 122.87 41.38 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.717 -0.846 . . . . 0.31 108.717 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -101.3 114.49 40.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 N-CA-C 107.823 -1.177 . . . . 0.19 107.823 179.432 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.467 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 79.9 mm-40 -97.88 0.07 45.95 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.751 -1.218 . . . . 2.25 110.098 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.0 p -154.19 157.75 39.28 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.087 -1.008 . . . . 0.15 110.951 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.14 -33.91 76.49 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.313 -0.995 . . . . 1.65 108.313 178.487 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.1 m -56.37 -47.95 77.85 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.626 -0.83 . . . . 0.23 109.066 -178.776 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.34 -29.58 68.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.199 -0.938 . . . . 0.17 109.28 178.517 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.566 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.5 t80 -59.66 -46.03 90.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.93 -1.106 . . . . 0.14 109.22 -179.315 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -65.52 -42.93 91.5 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.067 -0.716 . . . . 1.31 109.067 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -64.34 -36.09 82.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.719 -0.613 . . . . 1.77 109.819 179.57 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.92 -43.29 79.54 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.407 -0.808 . . . . 0.15 109.538 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.566 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.9 mt -61.4 -40.0 92.78 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.176 -0.953 . . . . 0.17 108.698 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -69.28 -38.38 78.32 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.658 0.742 . . . . 1.07 109.336 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.29 -35.48 76.07 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.488 0.661 . . . . 0.18 109.909 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.2 -22.19 64.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 0.17 110.462 -178.926 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -140.99 37.07 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.006 -1.568 . . . . 0.2 109.71 179.741 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.83 5.16 49.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.379 -1.071 . . . . 1.07 110.688 -179.11 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.0 mttm -74.06 152.29 39.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.878 -1.138 . . . . 1.5 109.676 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.673 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.01 154.76 18.33 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 108.197 -1.038 . . . . 0.47 108.197 -179.37 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.649 ' H ' HD23 ' A' ' 22' ' ' LEU . 58.2 t -142.56 113.41 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.987 -1.071 . . . . 0.17 109.358 -179.693 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.45 142.57 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 108.087 -1.079 . . . . 0.14 108.087 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.0 t -125.51 123.16 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.453 -0.779 . . . . 0.13 109.553 -178.992 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.517 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 35.5 t70 -98.99 119.54 37.94 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 1.05 109.953 179.588 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -96.63 25.82 4.89 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.237 -0.914 . . . . 0.73 109.577 179.433 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.418 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.2 m -59.99 145.52 45.9 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.146 -0.971 . . . . 0.3 110.23 -178.731 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.713 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.98 124.21 30.81 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.919 -1.141 . . . . 0.22 107.919 179.189 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.1 t -68.24 -29.0 67.71 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 119.29 -0.964 . . . . 0.3 108.585 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.713 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 70.3 p-90 -76.42 -13.74 60.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.023 -1.048 . . . . 0.26 109.881 179.855 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.6 t -90.27 115.64 27.64 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.26 108.596 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.422 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.94 -53.99 40.58 Favored Glycine 0 N--CA 1.489 2.23 0 C-N-CA 120.41 -0.9 . . . . 0.23 111.33 -178.798 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -50.35 -35.55 44.81 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 CA-C-N 118.768 1.284 . . . . 0.31 112.096 -179.835 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.418 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.21 -47.16 18.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 0.24 110.008 -179.545 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.93 -32.21 70.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.176 -0.953 . . . . 1.59 109.348 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.502 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.83 -29.19 68.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.551 -0.718 . . . . 2.1 110.243 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.559 HD11 ' HB1' ' A' ' 92' ' ' ALA . 21.4 mt -80.99 -4.41 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.655 -0.653 . . . . 0.49 111.069 -179.036 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.01 -31.76 10.16 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 120.138 -1.601 . . . . 0.8 113.211 -177.409 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.76 -36.38 91.57 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 121.573 1.597 . . . . 0.28 112.162 -178.421 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -72.37 -51.81 18.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 118.953 -1.099 . . . . 0.37 108.498 179.588 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.81 -47.23 86.53 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.391 -0.818 . . . . 0.16 109.056 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -68.36 -43.03 78.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.557 -0.715 . . . . 0.32 110.877 179.667 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.8 m -64.03 -38.23 90.3 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.954 -1.091 . . . . 0.22 110.679 -179.306 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.92 -23.92 66.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.396 -0.815 . . . . 0.22 110.735 -178.376 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.2 m -54.26 -38.05 65.37 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.793 -1.192 . . . . 0.16 108.397 -179.426 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.63 -17.87 40.07 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.283 -0.886 . . . . 2.16 109.256 178.948 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -76.34 -36.82 58.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.749 -1.219 . . . . 1.78 108.004 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -123.53 65.69 1.01 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 106.58 -1.637 . . . . 0.25 106.58 178.108 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -62.41 -9.78 9.42 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.53 -0.915 . . . . 0.22 108.53 -179.396 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -89.37 8.9 28.31 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.787 -1.19 . . . . 1.13 107.787 178.727 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.428 HG13 ' HB3' ' A' ' 22' ' ' LEU . 58.4 t -127.87 145.16 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 N-CA-C 108.161 -1.052 . . . . 0.24 108.161 179.152 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.01 122.47 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.065 -1.022 . . . . 0.15 109.249 -179.12 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.602 ' C ' HD12 ' A' ' 55' ' ' LEU . 33.4 m-85 -103.68 129.31 50.99 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.169 -0.957 . . . . 0.12 109.521 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.602 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -111.94 142.37 44.43 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.126 -0.984 . . . . 0.22 109.985 179.168 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 107.016 -1.476 . . . . 1.13 107.016 177.732 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.7 t -128.86 134.38 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.477 -0.765 . . . . 0.15 110.748 -177.888 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.573 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.9 t0 -95.19 119.8 34.32 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.485 -0.759 . . . . 1.05 109.232 179.614 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.91 -16.68 21.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.575 -1.328 . . . . 0.16 108.306 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.545 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.1 m-20 -94.1 -44.12 8.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.439 -0.788 . . . . 1.08 111.696 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 61' ' ' ASP . . . . . 0.456 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 68.7 m-20 -95.81 -14.36 23.33 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.728 -1.232 . . . . 1.07 108.654 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.03 38.23 4.24 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 107.364 -1.347 . . . . 0.14 107.364 179.27 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -59.94 -23.17 63.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.758 -0.589 . . . . 1.47 110.065 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.579 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.7 p30 -65.94 -37.58 86.4 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.042 -1.036 . . . . 1.05 108.9 179.171 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.579 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.8 t -71.34 -44.1 72.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.263 -0.898 . . . . 0.35 109.548 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.09 70.57 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.442 -0.786 . . . . 0.26 111.14 -178.449 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.0 p -60.06 -32.88 71.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.084 -1.01 . . . . 0.24 109.157 -179.243 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -60.66 -38.33 84.53 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.958 -0.756 . . . . 2.06 108.958 179.176 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -92.02 1.4 57.22 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.438 -0.789 . . . . 0.23 110.809 -179.251 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 54.89 50.51 15.45 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.025 -1.047 . . . . 2.02 109.306 -179.328 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 133.1 30.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 118.324 -1.35 . . . . 0.16 107.959 -179.283 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -105.79 -10.99 16.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 1.6 109.917 -179.121 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.49 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -161.27 156.04 23.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.848 -1.157 . . . . 0.14 111.214 -179.654 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 154.36 81.04 Favored Pre-proline 0 N--CA 1.503 2.204 0 N-CA-C 108.263 -1.014 . . . . 0.15 108.263 179.059 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -76.42 141.63 70.69 Favored 'Cis proline' 0 N--CA 1.495 1.588 0 C-N-CA 123.929 -1.28 . . . . 0.16 112.799 -2.505 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -127.47 132.54 49.99 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.648 0.737 . . . . 0.13 109.39 178.832 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.814 ' CD2' HD21 ' A' ' 97' ' ' LEU . 88.7 m-85 -108.52 131.75 54.51 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.011 -0.737 . . . . 0.2 109.011 179.979 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.7 mt-30 -120.72 143.04 48.98 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.395 -0.965 . . . . 0.29 108.395 179.121 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' HG21 ' A' ' 100' ' ' THR . 75.0 m-85 -109.0 133.49 52.91 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 121.708 0.766 . . . . 0.14 110.449 -179.249 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -128.83 143.6 50.95 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 109.383 -0.599 . . . . 0.15 109.383 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -146.37 125.93 13.3 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.71 -1.589 . . . . 1.68 106.71 178.807 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 58.29 29.42 18.05 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.559 -0.904 . . . . 1.22 108.559 -178.466 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.7 11.73 85.16 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.744 -1.342 . . . . 0.23 109.744 -179.909 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 10.2 mm100 -111.43 132.39 54.5 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.509 -0.994 . . . . 2.07 109.989 -179.053 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -78.41 121.01 23.95 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.048 -1.093 . . . . 1.82 108.048 178.538 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -123.99 11.47 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.777 -0.577 . . . . 0.3 110.627 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -174.2 151.42 12.87 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 118.175 -1.964 . . . . 0.17 112.137 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 3.8 tp10 -163.75 140.22 6.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.923 -0.751 . . . . 1.93 109.218 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.466 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 3.9 p90 -163.87 156.86 18.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.568 -0.707 . . . . 0.14 109.246 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.71 160.25 31.34 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.596 -0.69 . . . . 0.12 110.064 -179.337 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.499 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.85 139.43 5.26 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.347 -1.501 . . . . 0.12 109.347 179.465 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.559 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.54 63.45 2.06 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.353 -1.086 . . . . 0.18 109.68 -179.839 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -118.76 102.25 8.68 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.732 -0.84 . . . . 0.88 108.732 178.557 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.7 -36.25 75.77 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.338 -0.851 . . . . 1.06 111.613 -179.846 . . . . . . . . 3 3 . 1 . 030 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.2 -29.41 69.8 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.844 -1.16 . . . . 1.61 109.472 -179.822 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.489 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 50.5 tttp -60.98 -36.11 78.57 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.591 -0.693 . . . . 1.45 109.205 -179.242 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.814 HD21 ' CD2' ' A' ' 77' ' ' PHE . 45.1 mt -59.05 -39.93 83.56 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-O 122.1 0.952 . . . . 0.19 108.924 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -63.02 -41.58 99.58 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.074 -0.65 . . . . 2.1 111.077 -178.115 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.03 -43.25 79.19 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.059 -1.026 . . . . 0.19 111.526 -178.293 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 100' ' ' THR . . . . . 0.417 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.7 m -66.75 -39.94 88.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.858 -1.151 . . . . 0.2 109.892 -178.332 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.93 -48.97 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.237 -1.023 . . . . 0.16 108.237 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.454 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.7 t-20 -60.16 -35.63 75.74 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.998 0.904 . . . . 0.95 108.675 178.616 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.54 -39.79 85.02 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.994 -0.548 . . . . 2.21 109.956 -177.976 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.673 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.5 mt -99.79 -1.64 37.13 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.258 -0.901 . . . . 0.25 111.189 -179.173 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.454 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.401 -1.437 . . . . 1.08 109.12 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo . . . . . 0 N--CA 1.494 1.543 0 CA-C-O 121.141 0.392 . . . . 1.46 112.24 . . . . . . . . . 0 0 . 1 . 030 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.74 124.25 37.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.142 -0.974 . . . . 0.88 108.808 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.468 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.5 m -107.2 130.12 54.77 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.22 -0.925 . . . . 0.7 109.624 -179.261 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.07 -29.13 68.02 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.838 . . . . 0.61 109.33 179.256 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.468 ' H ' HG22 ' B' ' 61' ' ' THR . 42.5 mmtm -62.18 -19.97 63.66 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.451 -0.78 . . . . 1.31 110.373 -179.055 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.499 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.5 mm -132.78 142.77 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.523 -0.735 . . . . 0.15 109.149 -179.814 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -103.88 125.86 50.6 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 106.803 -1.554 . . . . 0.19 106.803 177.431 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -79.33 143.85 34.77 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.849 -1.157 . . . . 0.2 111.227 -178.1 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.49 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.3 m95 -75.91 -10.56 59.52 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.229 -0.919 . . . . 0.21 108.718 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 14.5 m-20 -51.57 -12.12 0.16 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.589 -0.893 . . . . 0.49 108.589 -179.914 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.464 ' N ' ' C ' ' B' ' 67' ' ' TRP . 15.5 m -65.26 142.67 16.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.357 -0.839 . . . . 1.04 108.775 179.067 . . . . . . . . 2 2 . 1 . 030 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.92 -40.0 87.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.253 -0.905 . . . . 1.36 109.331 -179.464 . . . . . . . . 1 1 . 1 . 030 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.378 -1.489 . . . . 2.32 109.378 -179.812 . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 mmt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.155 0.502 . . . . 2.88 109.781 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.8 t -98.63 140.53 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.433 -0.792 . . . . 0.45 109.534 -179.932 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -130.43 130.18 43.96 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.417 -0.802 . . . . 1.67 109.065 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -97.03 123.2 40.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.512 -0.742 . . . . 0.31 109.176 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.34 115.53 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.204 -0.935 . . . . 0.19 108.674 178.712 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -98.15 -0.42 44.33 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 2.25 109.344 179.518 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.57 155.6 35.07 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.672 -1.267 . . . . 0.15 111.944 -179.634 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.23 -33.16 74.06 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.138 -1.06 . . . . 1.65 108.138 178.389 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 80.3 m -58.12 -47.83 82.07 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.406 -0.809 . . . . 0.23 109.329 -179.473 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.74 -30.71 68.38 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.154 -0.966 . . . . 0.17 108.623 178.843 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.492 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.1 t80 -59.57 -43.77 93.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.146 -0.971 . . . . 0.14 108.849 -179.372 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -64.24 -43.31 95.32 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.123 -0.695 . . . . 1.31 109.123 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 13' ' ' GLU . . . . . 0.557 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -64.4 -39.34 93.66 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.505 -0.747 . . . . 1.77 110.353 179.957 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.85 -41.22 91.97 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.426 -0.796 . . . . 0.15 108.95 -179.301 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.492 HD11 ' CE2' ' A' ' 11' ' ' PHE . 51.6 mt -62.15 -39.99 94.46 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.911 -1.118 . . . . 0.17 108.809 179.414 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.86 -34.8 74.09 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.424 -0.797 . . . . 1.07 109.95 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.45 -36.77 76.93 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.326 -0.859 . . . . 0.18 110.212 -179.606 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.54 80.59 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.229 -0.919 . . . . 0.17 109.373 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.32 -124.58 22.59 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.656 -1.377 . . . . 0.2 109.656 -179.415 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -89.98 2.07 55.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.11 -1.229 . . . . 1.07 110.592 -178.797 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -74.61 150.22 39.74 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.829 -1.169 . . . . 1.5 109.697 -179.933 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.685 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -61.34 156.24 19.41 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.075 -1.454 . . . . 0.47 107.075 179.741 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.599 ' H ' HD23 ' A' ' 22' ' ' LEU . 78.7 t -143.46 112.69 2.03 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 120.991 -1.068 . . . . 0.17 108.94 -179.532 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -103.0 138.85 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 108.498 -0.927 . . . . 0.14 108.498 179.776 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.1 t -122.08 119.66 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.488 -0.757 . . . . 0.13 109.16 -179.441 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.571 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.5 t70 -98.99 109.09 21.9 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.525 -0.735 . . . . 1.05 110.344 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -89.95 102.81 15.52 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 106.754 -1.573 . . . . 0.73 106.754 177.548 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.0 m -129.01 146.56 50.95 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.794 -0.817 . . . . 0.3 108.794 -179.743 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.552 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.73 122.67 30.15 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.777 -1.194 . . . . 0.22 107.777 179.104 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -65.72 -34.09 77.38 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 118.92 -1.112 . . . . 0.3 108.724 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.552 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 46.2 p-90 -70.73 -23.56 62.46 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.366 -0.833 . . . . 0.26 110.634 179.797 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -84.2 112.97 20.75 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.621 -1.251 . . . . 0.26 107.621 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.494 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.61 -49.16 81.53 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 120.415 -0.898 . . . . 0.23 111.086 -178.298 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.6 Cg_exo -53.46 -35.38 75.77 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 CA-C-N 118.616 1.208 . . . . 0.31 112.704 179.913 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.97 -55.77 5.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.228 -0.92 . . . . 0.24 109.928 -179.682 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -59.82 -37.43 79.17 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.144 -0.973 . . . . 1.59 109.421 -179.837 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.401 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 37.6 ttm -59.69 -28.95 67.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.995 . . . . 2.1 109.994 -179.618 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.586 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -80.05 -4.5 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.725 -0.609 . . . . 0.49 110.926 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -65.39 -26.11 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 120.382 -1.449 . . . . 0.8 114.604 -177.548 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.6 Cg_exo -57.56 -37.99 95.25 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 CA-C-N 122.536 1.941 . . . . 0.28 113.148 -176.648 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -69.88 -43.31 72.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.049 -1.46 . . . . 0.37 108.478 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -63.65 -50.57 68.76 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.001 0.905 . . . . 0.16 109.788 179.208 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -68.01 -44.03 77.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 121.237 0.541 . . . . 0.32 109.691 179.701 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.1 m -60.71 -37.15 80.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.983 -1.073 . . . . 0.22 110.498 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -63.48 -22.3 66.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.705 -1.247 . . . . 0.22 110.833 -178.527 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -53.71 -37.4 63.26 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.967 -1.083 . . . . 0.16 108.279 -179.252 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 54.7 mp0 -85.65 -17.73 35.24 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.066 -1.021 . . . . 2.16 109.47 179.708 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.28 -35.71 54.87 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.754 -1.202 . . . . 1.78 107.754 179.228 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -124.94 66.57 1.11 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 106.906 -1.516 . . . . 0.25 106.906 178.025 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -64.2 -7.96 10.88 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.829 -0.804 . . . . 0.22 108.829 -179.129 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -91.09 10.16 27.97 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 108.458 -0.941 . . . . 1.13 108.458 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.401 HG13 ' HB3' ' A' ' 22' ' ' LEU . 44.7 t -128.03 149.92 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 N-CA-C 107.996 -1.113 . . . . 0.24 107.996 179.392 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.0 mm -100.72 122.19 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.791 -1.193 . . . . 0.15 109.044 -178.839 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.623 ' C ' HD12 ' A' ' 55' ' ' LEU . 63.6 m-85 -106.95 128.88 54.72 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.071 -1.018 . . . . 0.12 109.33 179.753 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.623 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -114.95 142.25 46.87 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.924 -1.11 . . . . 0.22 109.5 179.183 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -111.77 130.13 55.9 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 106.753 -1.573 . . . . 1.13 106.753 177.703 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -126.39 137.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.267 -0.896 . . . . 0.15 111.741 -177.571 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.2 t0 -99.1 119.56 38.04 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.702 -0.851 . . . . 1.05 108.702 179.14 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -70.33 -16.95 20.4 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 O-C-N 120.946 -1.096 . . . . 0.16 108.918 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 4.3 m-20 -95.2 -39.6 10.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 1.08 111.547 -179.376 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -96.24 -17.96 20.38 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 120.832 -1.167 . . . . 1.07 108.216 179.453 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.92 41.2 3.57 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.477 -1.305 . . . . 0.14 107.477 179.031 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.43 -25.67 66.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.831 -0.543 . . . . 1.47 109.697 -178.747 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.614 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -62.97 -38.68 92.08 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.912 -1.118 . . . . 1.05 109.162 179.241 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.614 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -70.51 -44.27 77.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 121.193 -0.942 . . . . 0.35 109.868 -179.843 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.01 -37.31 69.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.364 -0.835 . . . . 0.26 111.255 -178.879 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.0 p -60.27 -33.96 73.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.793 -1.192 . . . . 0.24 109.381 -178.865 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.67 -36.57 84.28 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.576 -0.702 . . . . 2.06 109.801 179.615 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.88 -1.95 58.35 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.426 -0.797 . . . . 0.23 111.302 -178.781 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 56.94 48.8 15.14 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.033 -1.042 . . . . 2.02 109.578 -179.288 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.0 t -64.39 129.78 28.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 120.809 -1.182 . . . . 0.16 108.056 -179.828 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -103.04 -11.77 17.9 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.718 -0.613 . . . . 1.6 109.982 -179.387 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.508 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.68 154.24 17.97 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.801 -1.187 . . . . 0.14 110.377 179.767 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.408 HG23 ' NE1' ' B' ' 67' ' ' TRP . 33.0 p -130.12 155.55 80.58 Favored Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.146 -0.971 . . . . 0.15 108.767 179.039 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -73.56 144.67 81.74 Favored 'Cis proline' 0 N--CA 1.493 1.495 0 C-N-CA 123.934 -1.277 . . . . 0.16 112.999 -2.586 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.4 m -130.1 134.7 47.53 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.033 -1.099 . . . . 0.13 108.033 178.69 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.571 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -109.88 131.25 55.23 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.426 -0.796 . . . . 0.2 109.129 -179.14 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -124.3 140.43 52.97 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.289 -1.004 . . . . 0.29 108.289 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -108.29 135.85 48.91 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 121.436 0.636 . . . . 0.14 110.232 -179.32 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.02 146.53 50.32 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.669 -0.863 . . . . 0.15 108.669 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -143.4 121.64 12.25 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.759 -1.2 . . . . 1.68 107.759 -179.843 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 60.03 27.35 16.76 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.596 -0.69 . . . . 1.22 109.857 -179.427 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.24 Favored Glycine 0 N--CA 1.495 2.623 0 O-C-N 120.899 -1.126 . . . . 0.23 110.994 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 93.3 mt-30 -127.05 142.2 51.59 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.049 -1.265 . . . . 2.07 110.172 -179.781 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 85' ' ' LYS . . . . . 0.457 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 33.1 ttpt -79.6 126.75 31.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.243 -0.911 . . . . 1.82 108.977 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.5 m -119.98 11.55 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.647 -0.658 . . . . 0.3 110.683 -179.21 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 165.03 157.31 9.61 Favored Glycine 0 N--CA 1.492 2.403 0 C-N-CA 118.501 -1.809 . . . . 0.17 111.492 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 12.3 pt-20 -165.97 158.11 14.45 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.775 -0.838 . . . . 1.93 109.794 179.231 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -164.09 163.26 23.21 Favored 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 119.27 -0.972 . . . . 0.14 109.976 176.844 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.26 160.73 29.51 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 121.633 0.73 . . . . 0.12 110.175 -179.357 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.527 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 116.58 141.77 7.2 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 108.776 -1.729 . . . . 0.12 108.776 -179.873 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.1 68.5 4.15 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.315 -1.109 . . . . 0.18 111.489 -178.84 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.447 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -117.84 100.4 7.56 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 108.289 -1.004 . . . . 0.88 108.289 177.871 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.469 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.03 -33.27 73.35 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.173 -0.954 . . . . 1.06 111.619 -179.263 . . . . . . . . 3 3 . 1 . 031 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.86 -29.06 69.45 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.621 -1.3 . . . . 1.61 110.063 -179.225 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.447 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 43.3 tttp -60.93 -34.31 74.51 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.509 -0.923 . . . . 1.45 108.509 -179.086 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.417 HD21 ' CD1' ' A' ' 77' ' ' PHE . 43.3 mt -60.13 -40.05 88.43 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.714 0.768 . . . . 0.19 109.008 179.777 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.32 -41.89 98.92 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.988 -0.685 . . . . 2.1 110.836 -177.827 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.94 -43.96 70.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.19 111.454 -178.514 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.6 m -65.3 -39.99 93.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.088 -1.007 . . . . 0.2 109.883 -178.76 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 101' ' ' ILE . . . . . 0.402 ' O ' ' N ' ' A' ' 105' ' ' VAL . 63.9 mt -61.52 -48.54 88.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 108.002 -1.11 . . . . 0.16 108.002 179.235 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.9 t-20 -60.2 -36.36 77.48 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.409 -0.96 . . . . 0.95 108.409 178.727 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.59 85.75 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.637 -0.505 . . . . 2.21 109.637 -178.984 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.685 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.9 mt -99.86 -3.15 33.15 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.126 -0.984 . . . . 0.25 111.626 -179.042 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.46 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.397 -1.439 . . . . 1.08 109.119 -179.518 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo . . . . . 0 N--CA 1.496 1.669 0 CA-C-O 120.946 0.311 . . . . 1.46 112.361 . . . . . . . . . 0 0 . 1 . 031 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.25 126.54 34.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.199 -0.938 . . . . 0.88 109.144 179.592 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -118.58 158.23 25.83 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.298 -0.876 . . . . 0.7 109.274 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.0 mt -64.09 -19.98 65.64 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 108.983 -0.747 . . . . 0.61 108.983 178.97 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -60.78 -25.0 66.22 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.428 -0.795 . . . . 1.31 110.228 -179.433 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.527 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.3 mm -129.92 146.99 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 109.543 -0.539 . . . . 0.15 109.543 -179.968 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 60.9 m -104.59 126.27 51.52 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 107.176 -1.416 . . . . 0.19 107.176 177.848 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.0 m -77.46 138.18 39.09 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.672 -1.267 . . . . 0.2 111.016 -178.567 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.44 ' C ' ' N ' ' B' ' 69' ' ' VAL . 19.8 m95 -75.05 -9.63 58.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.012 -1.055 . . . . 0.21 109.556 179.056 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 35.8 m-20 -52.63 -11.92 0.25 Allowed 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.335 -0.853 . . . . 0.49 109.122 -179.891 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.44 ' N ' ' C ' ' B' ' 67' ' ' TRP . 17.3 m -59.85 136.91 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.267 -0.896 . . . . 1.04 108.852 179.403 . . . . . . . . 2 2 . 1 . 031 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -60.36 -35.48 75.77 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.545 -0.722 . . . . 1.36 109.65 -179.098 . . . . . . . . 1 1 . 1 . 031 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 CA-C-O 118.001 -1.444 . . . . 2.32 109.582 179.911 . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.267 0.556 . . . . 2.88 109.598 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 80.1 t -98.71 143.21 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.454 -0.779 . . . . 0.45 109.572 -179.679 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -130.58 129.85 43.3 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 108.238 -1.023 . . . . 1.67 108.238 179.94 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -98.13 124.52 42.71 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.21 -0.931 . . . . 0.31 108.96 179.566 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.2 mm -100.92 113.83 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.389 -0.819 . . . . 0.19 108.824 179.165 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -98.47 -0.38 43.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.318 -0.864 . . . . 2.25 109.395 179.077 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -154.33 155.7 35.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.971 -1.081 . . . . 0.15 111.324 179.587 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -62.66 -30.92 71.74 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.247 -1.02 . . . . 1.65 108.247 178.478 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.1 m -59.02 -48.7 80.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.35 -0.94 . . . . 0.23 108.701 -179.573 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.14 -28.8 67.62 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.85 -0.74 . . . . 0.17 109.067 179.079 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.478 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.0 t80 -59.89 -43.84 94.55 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.097 -1.002 . . . . 0.14 108.568 -179.683 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.89 -42.17 85.97 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.312 -0.625 . . . . 1.31 109.312 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.8 -37.14 86.6 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.43 0.633 . . . . 1.77 110.046 -179.814 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.06 80.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.289 -0.882 . . . . 0.15 108.999 -179.696 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.478 HD11 ' CE2' ' A' ' 11' ' ' PHE . 71.2 mt -61.02 -39.84 91.3 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.108 -0.995 . . . . 0.17 108.917 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.65 -35.27 75.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.532 -0.73 . . . . 1.07 110.2 -179.629 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.05 -37.5 75.57 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.341 -0.849 . . . . 0.18 110.801 -178.952 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.11 72.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.098 -1.002 . . . . 0.17 109.757 -179.503 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.22 20.23 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 110.24 -1.144 . . . . 0.2 110.24 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 20' ' ' ASP . . . . . 0.402 ' OD1' ' NZ ' ' A' ' 82' ' ' LYS . 70.7 m-20 -90.7 1.76 56.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.157 -1.201 . . . . 1.07 110.554 -178.48 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -75.73 150.12 37.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.014 -1.054 . . . . 1.5 110.251 -178.807 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.693 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.93 154.26 22.81 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 107.605 -1.257 . . . . 0.47 107.605 -179.665 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.693 ' H ' HD23 ' A' ' 22' ' ' LEU . 90.4 t -144.41 116.13 2.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.057 -1.027 . . . . 0.17 108.646 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.2 t -105.08 142.6 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 107.959 -1.126 . . . . 0.14 107.959 179.497 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 25' ' ' VAL . . . . . 0.4 ' CG1' HG21 ' A' ' 57' ' ' VAL . 21.7 t -125.31 123.17 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 O-C-N 121.179 -0.951 . . . . 0.13 109.514 -179.233 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.558 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 32.8 t70 -100.64 120.07 39.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.343 -0.848 . . . . 1.05 110.427 179.303 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -97.29 25.58 5.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.335 -0.853 . . . . 0.73 110.336 179.315 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.3 m -59.47 146.62 39.63 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.923 -1.111 . . . . 0.3 110.061 -178.662 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.588 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.15 126.84 33.04 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.699 -1.223 . . . . 0.22 107.699 179.34 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 t -68.06 -34.92 77.34 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.148 -1.021 . . . . 0.3 108.365 -179.841 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.588 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.8 p-90 -69.86 -22.34 63.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.43 -0.794 . . . . 0.26 110.539 179.576 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.7 t -85.11 106.49 16.61 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.526 -1.287 . . . . 0.26 107.526 179.695 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.518 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.83 -46.85 92.92 Favored Glycine 0 N--CA 1.487 2.08 0 C-N-CA 120.363 -0.922 . . . . 0.23 111.084 -178.469 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -52.35 -36.21 67.82 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.942 1.371 . . . . 0.31 111.663 179.682 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.16 -49.4 13.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.493 -0.754 . . . . 0.24 109.954 179.98 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -59.9 -31.55 69.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.232 -0.918 . . . . 1.59 109.276 179.894 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.519 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -59.91 -29.79 68.6 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.252 -0.905 . . . . 2.1 109.587 -179.465 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 mt -81.55 -8.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.532 -0.73 . . . . 0.49 111.34 -179.186 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.517 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.5 ptmt -61.67 -28.38 3.95 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 120.27 -1.519 . . . . 0.8 113.621 -177.253 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.9 Cg_exo -57.63 -37.84 95.51 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 122.696 1.999 . . . . 0.28 112.178 -176.828 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -68.57 -47.72 66.07 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.601 -1.24 . . . . 0.37 108.113 179.306 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -60.34 -52.12 66.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.669 -0.644 . . . . 0.16 109.674 178.752 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -68.2 -40.28 82.2 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.478 -0.764 . . . . 0.32 110.836 -179.724 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.42 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.9 m -62.81 -39.08 93.18 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.952 -1.093 . . . . 0.22 110.666 -179.802 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.5 mt -63.18 -23.9 67.64 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.163 -0.961 . . . . 0.22 111.044 -178.383 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -53.33 -36.78 61.66 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 120.712 -1.243 . . . . 0.16 108.699 -179.18 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.2 mp0 -87.24 -14.02 42.2 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.267 -0.896 . . . . 2.16 109.179 179.395 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.29 -38.07 36.23 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.152 -1.425 . . . . 1.78 107.152 178.908 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.74 68.28 0.91 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 106.856 -1.535 . . . . 0.25 106.856 178.002 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.66 -9.07 12.0 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.748 -0.834 . . . . 0.22 108.748 -179.331 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.04 7.18 36.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.875 -1.157 . . . . 1.13 107.875 178.861 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.9 t -127.45 144.82 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 107.791 -1.189 . . . . 0.24 107.791 178.777 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.6 mm -100.02 121.05 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.027 -1.046 . . . . 0.15 109.419 -178.804 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.568 ' C ' HD12 ' A' ' 55' ' ' LEU . 35.6 m-85 -102.06 125.54 48.77 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.16 -0.963 . . . . 0.12 109.2 179.266 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.592 HD12 ' N ' ' A' ' 55' ' ' LEU . 6.7 mp -108.63 140.87 41.39 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.04 -1.038 . . . . 0.22 109.361 179.613 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -108.92 132.07 54.42 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.273 -1.751 . . . . 1.13 106.273 177.978 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 57' ' ' VAL . . . . . 0.4 HG21 ' CG1' ' A' ' 25' ' ' VAL . 42.5 t -130.72 133.61 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.295 -0.878 . . . . 0.15 110.76 -177.659 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.614 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.0 t0 -96.02 119.0 33.73 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.865 -0.791 . . . . 1.05 108.865 179.681 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.25 -16.82 21.5 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 O-C-N 120.524 -1.36 . . . . 0.16 108.784 179.319 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.54 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.3 m-20 -94.78 -40.19 9.89 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.433 -0.792 . . . . 1.08 111.623 -178.467 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -98.09 -15.46 19.97 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.826 -1.171 . . . . 1.07 107.938 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.614 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.89 38.47 4.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.621 -1.251 . . . . 0.14 107.621 179.389 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -59.88 -27.74 66.96 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.731 -0.605 . . . . 1.47 109.859 -178.608 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.548 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -64.03 -36.0 82.55 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.686 -1.259 . . . . 1.05 109.155 179.591 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.548 HG23 ' OD1' ' A' ' 64' ' ' ASP . 5.7 t -71.76 -44.06 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.309 -0.869 . . . . 0.35 109.622 179.914 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.75 69.04 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.384 -0.822 . . . . 0.26 110.287 -179.187 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -60.11 -30.47 69.28 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.197 -0.94 . . . . 0.24 108.97 -179.442 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -60.54 -39.92 89.64 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.909 -0.775 . . . . 2.06 108.909 178.881 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -91.46 0.93 57.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.28 -0.887 . . . . 0.23 110.717 -179.309 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 55.76 49.97 15.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.992 -1.068 . . . . 2.02 109.134 -178.945 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -62.8 130.51 27.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 C-N-CA 118.323 -1.351 . . . . 0.16 108.363 -178.924 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -102.22 -10.63 19.41 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.656 -0.652 . . . . 1.6 109.889 -178.933 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.47 156.09 18.24 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.698 -1.251 . . . . 0.14 111.129 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -126.79 155.66 74.93 Favored Pre-proline 0 N--CA 1.497 1.903 0 N-CA-C 107.699 -1.222 . . . . 0.15 107.699 178.309 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -76.84 140.1 63.24 Favored 'Cis proline' 0 N--CA 1.492 1.411 0 C-N-CA 123.63 -1.404 . . . . 0.16 112.271 -2.275 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.0 m -125.14 132.52 53.07 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.816 -0.809 . . . . 0.13 108.816 177.799 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.558 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.4 m-85 -110.51 131.4 55.08 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.752 -0.832 . . . . 0.2 108.752 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 24.5 mt-30 -122.89 139.13 54.37 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.322 -0.861 . . . . 0.29 109.11 179.465 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -105.12 136.21 45.03 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.332 0.586 . . . . 0.14 110.401 -179.392 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -129.07 146.99 50.89 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 109.258 -0.645 . . . . 0.15 109.258 179.362 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -145.93 122.67 11.21 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.615 -1.254 . . . . 1.68 107.615 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 82' ' ' LYS . . . . . 0.402 ' NZ ' ' OD1' ' A' ' 20' ' ' ASP . 55.3 mttm 56.71 34.49 24.68 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.998 -1.064 . . . . 1.22 109.043 -177.945 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.22 20.44 79.65 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 109.894 -1.282 . . . . 0.23 109.894 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 41.5 mm-40 -123.96 132.13 53.67 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.369 -1.077 . . . . 2.07 110.794 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -79.02 124.01 27.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.422 -0.799 . . . . 1.82 109.021 178.923 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.82 9.27 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.656 -0.652 . . . . 0.3 110.977 -179.634 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.85 155.43 15.53 Favored Glycine 0 N--CA 1.495 2.586 0 C-N-CA 118.244 -1.931 . . . . 0.17 111.569 -179.616 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -166.78 148.73 6.28 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.818 -0.813 . . . . 1.93 109.549 179.512 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 10.4 p90 -163.91 159.5 21.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.14 109.377 178.348 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.3 p -125.79 162.31 25.4 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.044 -0.724 . . . . 0.12 109.044 -179.525 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.448 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.11 139.78 5.67 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.586 -1.406 . . . . 0.12 109.586 179.831 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 63.6 1.93 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.453 -1.028 . . . . 0.18 110.338 -179.64 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.2 t-20 -119.12 99.93 7.02 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.531 -0.914 . . . . 0.88 108.531 178.541 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.438 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.1 OUTLIER -69.8 -31.43 69.33 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 1.06 111.597 -179.201 . . . . . . . . 3 3 . 1 . 032 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.14 -28.87 69.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.779 -1.201 . . . . 1.61 109.763 -179.589 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 96' ' ' LYS . . . . . 0.428 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 77.1 tttt -61.19 -34.97 75.92 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.655 -0.868 . . . . 1.45 108.655 -179.432 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.1 mt -59.97 -39.85 87.08 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 122.124 0.964 . . . . 0.19 108.478 179.01 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -61.18 -41.46 96.83 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.853 -0.612 . . . . 2.1 111.293 -178.115 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.36 73.0 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.851 -1.156 . . . . 0.19 112.168 -178.082 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.9 m -66.56 -39.7 88.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.73 -1.232 . . . . 0.2 110.142 -178.485 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.4 mt -60.18 -50.59 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.106 -0.996 . . . . 0.16 108.699 179.897 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.495 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.4 t30 -61.5 -33.62 74.1 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.694 -0.854 . . . . 0.95 108.694 179.189 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -68.1 -41.38 81.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 2.21 110.69 -178.956 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.624 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.4 mt -97.64 -2.14 42.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -0.925 . . . . 0.25 110.951 -178.683 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.2 p . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.624 -1.298 . . . . 1.08 109.222 -179.526 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 N--CA 1.494 1.517 0 CA-C-O 121.399 0.5 . . . . 1.46 111.865 . . . . . . . . . 0 0 . 1 . 032 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.61 123.72 37.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.347 -0.846 . . . . 0.88 109.069 179.883 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.431 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.2 m -104.5 129.74 52.5 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.377 -0.827 . . . . 0.7 109.637 -179.741 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.71 -29.99 70.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.235 -0.915 . . . . 0.61 109.472 179.581 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.431 ' H ' HG22 ' B' ' 61' ' ' THR . 60.3 mmtt -60.64 -17.49 47.63 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.393 -0.817 . . . . 1.31 109.256 -179.2 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.448 HD11 ' HA2' ' A' ' 91' ' ' GLY . 38.5 mm -128.83 140.37 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 N-CA-C 109.411 -0.589 . . . . 0.15 109.411 179.845 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.8 m -100.97 126.79 47.65 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.492 -1.299 . . . . 0.19 107.492 177.549 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.8 m -79.01 140.82 37.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.781 -1.2 . . . . 0.2 110.909 -178.512 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.474 ' C ' ' N ' ' B' ' 69' ' ' VAL . 22.1 m95 -74.27 -10.01 59.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.898 . . . . 0.21 109.578 179.499 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 45.0 m-20 -51.7 -12.37 0.19 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.137 -0.977 . . . . 0.49 108.457 -179.869 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.474 ' N ' ' C ' ' B' ' 67' ' ' TRP . 21.2 m -64.09 146.19 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.449 -0.782 . . . . 1.04 109.198 179.425 . . . . . . . . 2 2 . 1 . 032 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -60.28 -41.0 92.39 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.13 -0.981 . . . . 1.36 109.806 -179.497 . . . . . . . . 1 1 . 1 . 032 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.381 0 CA-C-O 117.964 -1.465 . . . . 2.32 109.735 -179.842 . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.2 mmm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.27 -0.641 . . . . 2.88 109.27 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.0 t -99.08 147.0 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.204 -0.935 . . . . 0.45 109.468 -179.837 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -129.94 125.52 35.66 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.81 -0.811 . . . . 1.67 108.81 -179.778 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -97.86 126.1 43.07 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.237 -1.023 . . . . 0.31 108.237 179.464 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.4 mm -100.04 112.06 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.262 -1.014 . . . . 0.19 108.262 179.795 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -96.48 -0.38 49.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.13 -0.981 . . . . 2.25 109.727 -179.655 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -153.19 155.43 36.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.967 -1.083 . . . . 0.15 110.841 179.765 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -64.25 -33.34 75.6 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 107.981 -1.118 . . . . 1.65 107.981 178.545 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 37.1 m -57.08 -48.23 79.1 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.49 -0.93 . . . . 0.23 108.49 -179.361 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.22 -29.25 68.04 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.83 . . . . 0.17 109.125 178.942 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.472 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.4 t80 -60.04 -44.64 94.52 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -0.949 . . . . 0.14 108.731 -179.942 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -65.38 -43.57 90.29 Favored 'General case' 0 C--N 1.297 -1.704 0 C-N-CA 119.64 -0.824 . . . . 1.31 109.031 179.631 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.8 -36.34 84.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.4 -0.813 . . . . 1.77 110.282 179.383 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -43.24 79.34 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.454 -0.779 . . . . 0.15 108.975 -179.503 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.472 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.2 mt -60.37 -40.22 90.07 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.027 -1.101 . . . . 0.17 108.027 179.709 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.32 -34.64 74.95 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.281 -0.887 . . . . 1.07 109.861 179.841 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.2 -36.24 79.26 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.45 -0.781 . . . . 0.18 110.472 -179.109 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.12 -30.75 71.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.215 -0.928 . . . . 0.17 109.208 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.43 -126.44 25.1 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 109.358 -1.497 . . . . 0.2 109.358 -179.618 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -91.69 3.54 54.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.32 -1.106 . . . . 1.07 110.804 -179.273 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -74.86 149.45 39.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.663 -1.273 . . . . 1.5 108.995 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.687 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.59 160.14 5.82 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 106.992 -1.484 . . . . 0.47 106.992 179.369 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.687 ' H ' HD23 ' A' ' 22' ' ' LEU . 95.7 t -147.5 119.63 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 O-C-N 120.962 -1.086 . . . . 0.17 108.321 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.416 HG22 ' CE2' ' A' ' 79' ' ' PHE . 45.4 t -106.91 142.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 107.721 -1.214 . . . . 0.14 107.721 179.267 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.9 t -124.64 120.2 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.349 -0.844 . . . . 0.13 108.913 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 26' ' ' ASP . . . . . 0.567 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.4 t70 -98.61 108.71 21.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.331 -0.856 . . . . 1.05 111.628 -179.319 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -90.1 101.01 13.73 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.4 -1.704 . . . . 0.73 106.4 176.602 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.3 m -129.94 145.59 51.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.955 -1.128 . . . . 0.3 107.955 -179.66 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.773 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.15 122.98 29.59 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.567 -1.272 . . . . 0.22 107.567 179.474 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -63.3 -29.3 70.65 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.887 -1.153 . . . . 0.3 107.887 -179.859 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.773 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 69.6 p-90 -78.97 -10.95 59.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.475 -0.766 . . . . 0.26 111.144 -179.887 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 32' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 34.6 t -87.63 116.29 25.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.709 -1.244 . . . . 0.26 108.53 -179.674 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.467 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.47 -52.81 50.29 Favored Glycine 0 N--CA 1.487 2.068 0 C-N-CA 120.84 -0.695 . . . . 0.23 112.002 -178.472 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.6 Cg_endo -60.33 -28.87 87.66 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 CA-C-N 119.742 1.771 . . . . 0.31 113.148 -179.685 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.89 -47.46 21.11 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.721 -1.237 . . . . 0.24 110.018 -179.735 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -59.98 -32.27 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.293 -0.879 . . . . 1.59 109.411 179.601 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 18.3 tmm? -60.11 -29.64 68.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.591 -0.693 . . . . 2.1 109.639 -179.934 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 38' ' ' ILE . 16.9 mt -81.59 -5.79 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.791 -0.568 . . . . 0.49 111.282 -179.107 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.559 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.62 -31.04 8.52 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 119.896 -1.753 . . . . 0.8 113.427 -177.927 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.1 Cg_exo -60.04 -40.54 60.32 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 CA-C-N 121.297 1.499 . . . . 0.28 112.821 -178.204 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -70.17 -47.91 59.56 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.746 -1.222 . . . . 0.37 108.673 179.798 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.58 -50.66 72.64 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.302 -0.874 . . . . 0.16 109.004 179.481 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -67.85 -40.24 83.7 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.699 -0.625 . . . . 0.32 111.276 179.187 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 75.3 m -63.58 -39.31 94.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.647 -1.283 . . . . 0.22 110.635 -179.342 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.3 mt -60.13 -27.15 66.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.396 -0.815 . . . . 0.22 110.909 -178.571 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.5 m -50.09 -37.5 34.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.975 -1.078 . . . . 0.16 108.986 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.2 mp0 -87.59 -16.75 33.66 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.205 -0.935 . . . . 2.16 108.942 179.698 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -77.73 -35.99 51.32 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.316 -1.365 . . . . 1.78 107.316 179.462 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -124.28 69.21 1.07 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.261 -1.385 . . . . 0.25 107.261 177.953 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.0 p -65.66 -8.97 23.39 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.729 -0.841 . . . . 0.22 108.729 -179.511 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -91.13 10.15 28.12 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.72 146.42 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.706 -1.22 . . . . 0.24 107.706 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.93 121.43 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.818 -1.176 . . . . 0.15 109.78 -178.949 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.534 ' C ' HD12 ' A' ' 55' ' ' LEU . 45.6 m-85 -102.78 124.2 47.87 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.255 -0.903 . . . . 0.12 109.999 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.2 mp -110.18 142.7 41.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.266 -0.896 . . . . 0.22 109.017 178.872 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -113.02 130.32 56.18 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 106.738 -1.578 . . . . 1.13 106.738 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.77 134.18 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.051 -1.031 . . . . 0.15 111.171 -177.777 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.701 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 53.5 t0 -98.97 119.44 37.75 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.499 -0.926 . . . . 1.05 108.499 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.6 m -69.09 -17.7 22.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 O-C-N 120.734 -1.229 . . . . 0.16 108.889 179.349 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.0 m-20 -92.64 -39.95 11.02 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.44 -0.788 . . . . 1.08 110.939 -179.079 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -98.5 -12.25 21.47 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.864 -1.148 . . . . 1.07 107.935 178.976 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -127.58 39.33 3.9 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.285 -1.376 . . . . 0.14 107.285 179.3 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -59.78 -27.74 66.81 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 115.868 -0.606 . . . . 1.47 109.385 -178.757 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.69 -38.14 88.41 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.187 -0.946 . . . . 1.05 109.329 179.353 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.527 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 8.9 t -69.72 -44.15 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.121 -0.987 . . . . 0.35 109.364 -179.917 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.36 -39.14 71.46 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.743 -0.598 . . . . 0.26 110.592 -179.036 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -61.17 -36.35 79.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.038 -1.039 . . . . 0.24 109.844 -179.01 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -61.98 -37.19 83.88 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.09 -1.006 . . . . 2.06 109.392 179.431 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.71 -0.88 57.73 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.342 -0.849 . . . . 0.23 111.364 -178.672 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 56.3 52.2 10.49 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.203 -0.936 . . . . 2.02 109.438 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.7 t -66.48 130.94 32.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 118.371 -1.332 . . . . 0.16 108.575 -179.169 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -104.06 -11.01 17.61 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.681 -0.637 . . . . 1.6 109.522 -179.422 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.416 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.54 154.28 16.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.878 -1.139 . . . . 0.14 110.938 179.906 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.8 p -129.63 156.08 79.31 Favored Pre-proline 0 N--CA 1.499 1.988 0 N-CA-C 106.828 -1.545 . . . . 0.15 106.828 178.447 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -76.16 140.94 68.69 Favored 'Cis proline' 0 N--CA 1.49 1.292 0 C-N-CA 123.818 -1.326 . . . . 0.16 111.788 -3.04 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.9 m -128.46 135.1 49.0 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.68 -0.859 . . . . 0.13 108.68 178.784 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.567 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.3 m-85 -108.83 128.83 55.24 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.873 -0.788 . . . . 0.2 108.873 -179.43 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -121.15 140.02 52.56 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.62 -1.252 . . . . 0.29 107.62 178.773 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.416 ' CE2' HG22 ' A' ' 24' ' ' VAL . 69.6 m-85 -107.72 135.08 49.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.257 0.551 . . . . 0.14 110.241 -178.942 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -126.88 147.23 50.07 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.165 -0.68 . . . . 0.15 109.165 178.985 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -146.16 125.08 12.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 106.986 -1.487 . . . . 1.68 106.986 179.378 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 57.97 27.1 14.26 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.099 -1.074 . . . . 1.22 108.099 -178.296 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 80.53 11.3 84.26 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.112 -1.195 . . . . 0.23 110.112 179.944 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 12.0 mm100 -112.98 133.39 54.96 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.511 -0.994 . . . . 2.07 110.253 -179.26 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -81.47 120.02 24.47 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.583 -0.895 . . . . 1.82 108.583 178.858 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.6 m -121.76 13.01 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.857 -0.527 . . . . 0.3 110.517 -179.288 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.59 154.79 14.29 Favored Glycine 0 N--CA 1.496 2.687 0 C-N-CA 118.304 -1.903 . . . . 0.17 112.284 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -167.2 150.6 6.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.656 -0.908 . . . . 1.93 109.816 179.397 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -164.47 160.21 20.26 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 119.284 -0.966 . . . . 0.14 109.102 177.082 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.77 161.49 27.23 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.445 -0.784 . . . . 0.12 110.52 -179.055 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.433 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.51 138.91 5.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.574 -1.41 . . . . 0.12 109.574 179.16 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.05 67.17 1.7 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.269 -1.136 . . . . 0.18 109.765 -179.588 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 56.3 t-20 -118.89 96.97 5.47 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.813 -0.81 . . . . 0.88 108.813 178.877 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -70.15 -33.43 71.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.173 -0.954 . . . . 1.06 111.72 -179.55 . . . . . . . . 3 3 . 1 . 033 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -62.97 -30.2 71.4 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.693 -1.255 . . . . 1.61 108.641 -179.85 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -60.61 -36.59 78.96 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.449 0.643 . . . . 1.45 109.498 -179.844 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 97' ' ' LEU . . . . . 0.472 HD21 ' CD1' ' A' ' 77' ' ' PHE . 39.7 mt -59.05 -37.94 78.21 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.982 0.896 . . . . 0.19 108.624 179.886 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -62.89 -42.39 99.76 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 120.128 -0.629 . . . . 2.1 110.851 -177.815 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.88 -43.47 68.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.051 -1.03 . . . . 0.19 111.655 -178.399 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -64.65 -39.95 94.58 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.701 -1.249 . . . . 0.2 110.506 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.17 -48.89 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.15 -1.055 . . . . 0.16 108.15 179.252 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.423 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.0 t-20 -60.69 -34.03 73.74 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.543 -0.91 . . . . 0.95 108.543 178.904 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -68.01 -39.29 83.21 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.669 -0.645 . . . . 2.21 110.282 -178.883 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.66 ' HB2' HD11 ' A' ' 22' ' ' LEU . 92.5 mt -100.37 -3.72 30.56 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.407 -0.808 . . . . 0.25 110.978 -178.706 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.4 p . . . . . 0 N--CA 1.495 1.803 0 O-C-N 120.552 -1.343 . . . . 1.08 108.658 -179.762 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 N--CA 1.495 1.576 0 CA-C-O 121.282 0.451 . . . . 1.46 112.023 . . . . . . . . . 0 0 . 1 . 033 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.44 119.64 33.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.303 -0.873 . . . . 0.88 108.967 179.484 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.427 HG22 ' H ' ' B' ' 63' ' ' LYS . 24.1 m -109.69 129.51 55.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.363 -0.835 . . . . 0.7 109.21 179.979 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.8 mt -67.18 -29.58 69.3 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 0.61 109.762 -179.923 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.427 ' H ' HG22 ' B' ' 61' ' ' THR . 60.6 mmtt -62.61 -18.12 61.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.338 -0.851 . . . . 1.31 108.873 -179.704 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.433 HD11 ' HA2' ' A' ' 91' ' ' GLY . 36.1 mm -127.97 140.69 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 N-CA-C 109.199 -0.667 . . . . 0.15 109.199 -179.954 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.5 m -97.56 122.39 40.58 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 107.165 -1.42 . . . . 0.19 107.165 177.558 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.2 m -77.79 140.3 39.42 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.85 -1.156 . . . . 0.2 111.851 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.47 ' C ' ' N ' ' B' ' 69' ' ' VAL . 26.3 m95 -74.7 -11.98 60.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -0.9 . . . . 0.21 109.685 179.236 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 34.7 m-20 -50.39 -13.16 0.11 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.134 -0.979 . . . . 0.49 108.546 179.826 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.482 HG11 ' CH2' ' A' ' 31' ' ' TRP . 15.3 m -61.66 144.24 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.293 -0.879 . . . . 1.04 108.887 179.049 . . . . . . . . 2 2 . 1 . 033 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -59.97 -41.3 91.64 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.018 -1.051 . . . . 1.36 109.756 -179.204 . . . . . . . . 1 1 . 1 . 033 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 117.903 -1.498 . . . . 2.32 109.666 179.556 . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.2 ttm . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.274 -0.639 . . . . 2.88 109.274 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -98.31 153.54 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.329 -0.857 . . . . 0.45 109.35 -179.766 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -129.96 129.78 44.22 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.372 -0.973 . . . . 1.67 108.372 -179.798 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -96.63 122.79 39.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.239 -0.913 . . . . 0.31 108.856 -179.876 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.7 mm -100.62 111.55 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.19 108.678 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.2 mp0 -96.55 0.5 50.18 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.15 -0.969 . . . . 2.25 109.884 -179.421 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.1 p -154.13 156.12 36.63 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.026 -1.046 . . . . 0.15 111.04 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -64.74 -33.29 75.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.438 -0.949 . . . . 1.65 108.438 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 51.6 m -57.38 -46.31 83.55 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.48 -0.933 . . . . 0.23 108.48 -179.136 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 -31.85 70.37 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.903 -0.777 . . . . 0.17 108.903 178.689 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CE2' HD11 ' A' ' 15' ' ' LEU . 51.4 t80 -58.52 -43.73 89.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.304 -0.873 . . . . 0.14 109.046 -179.527 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -66.21 -42.76 88.29 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.529 -0.868 . . . . 1.31 108.891 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -63.63 -39.51 94.53 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.644 -0.66 . . . . 1.77 110.82 179.752 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.96 82.59 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.154 -0.966 . . . . 0.15 109.24 -179.659 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.508 HD11 ' CE2' ' A' ' 11' ' ' PHE . 79.7 mt -61.09 -40.15 92.63 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.087 -1.079 . . . . 0.17 108.087 179.218 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.04 -37.13 78.41 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.769 -0.582 . . . . 1.07 110.513 179.72 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.09 -36.03 79.13 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.146 -0.971 . . . . 0.18 110.27 -178.924 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.7 72.55 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.078 -1.014 . . . . 0.17 109.09 179.827 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.66 -124.02 23.45 Favored Glycine 0 N--CA 1.484 1.9 0 N-CA-C 109.417 -1.473 . . . . 0.2 109.417 -179.853 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -92.14 3.89 54.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.242 -1.152 . . . . 1.07 110.983 -179.301 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -75.8 148.71 38.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.751 -1.218 . . . . 1.5 109.118 -179.914 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.683 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.7 158.56 12.45 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 107.137 -1.431 . . . . 0.47 107.137 179.759 . . . . . . . . 3 3 . 1 . 034 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.639 ' H ' HD23 ' A' ' 22' ' ' LEU . 44.1 t -146.24 119.2 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 120.651 -1.281 . . . . 0.17 108.732 179.654 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.439 HG22 ' CE2' ' A' ' 79' ' ' PHE . 21.5 t -106.52 140.99 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.664 -1.236 . . . . 0.14 107.664 179.045 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.6 t -123.54 121.95 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.439 -0.788 . . . . 0.13 109.483 -179.075 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -100.14 120.26 39.6 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.493 -0.754 . . . . 1.05 109.919 179.883 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 23.31 7.16 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.257 -0.902 . . . . 0.73 110.137 179.507 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 28' ' ' SER . . . . . 0.464 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.0 m -57.43 146.26 30.08 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.032 -1.043 . . . . 0.3 110.639 -178.731 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.602 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.47 124.76 31.71 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 107.709 -1.219 . . . . 0.22 107.709 178.991 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -67.9 -33.59 75.0 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 118.657 -1.217 . . . . 0.3 108.453 -179.627 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.602 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 52.5 p-90 -70.04 -24.16 63.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.289 -0.882 . . . . 0.26 110.944 179.488 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.2 t -83.44 119.75 25.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.86 -1.15 . . . . 0.26 107.994 -179.456 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.449 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.58 -52.15 52.94 Favored Glycine 0 N--CA 1.49 2.241 0 C-N-CA 120.397 -0.906 . . . . 0.23 110.883 -178.383 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.9 Cg_exo -52.06 -37.39 68.35 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 CA-C-N 118.571 1.185 . . . . 0.31 112.635 179.59 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 35' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.38 -51.45 10.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.304 -0.873 . . . . 0.24 109.831 -179.808 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -60.07 -35.44 75.16 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.216 -0.928 . . . . 1.59 109.706 179.678 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.499 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.39 -27.74 66.27 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.502 -0.749 . . . . 2.1 109.789 -179.726 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 38' ' ' ILE . 59.9 mt -87.86 -0.84 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.644 -0.66 . . . . 0.49 111.157 -178.786 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.583 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 1.5 ptmt -64.84 -31.36 5.4 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.299 -1.501 . . . . 0.8 112.904 -178.69 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.6 Cg_exo -56.42 -39.4 91.55 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 CA-C-N 121.026 1.402 . . . . 0.28 113.277 -177.767 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -67.99 -47.23 69.12 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.279 -1.369 . . . . 0.37 108.292 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -60.14 -53.0 62.95 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.778 0.799 . . . . 0.16 110.155 178.805 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -68.63 -40.3 80.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.72 -0.613 . . . . 0.32 111.188 -179.42 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.422 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 67.1 m -62.62 -40.02 95.67 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.958 -1.089 . . . . 0.22 110.769 -179.45 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -63.12 -20.87 65.77 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.307 -0.871 . . . . 0.22 110.371 -178.493 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -52.08 -39.82 60.27 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 120.759 -1.213 . . . . 0.16 108.718 -178.982 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -82.74 -17.83 42.9 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.231 -0.918 . . . . 2.16 109.596 179.246 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -76.81 -35.99 57.23 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.675 -1.266 . . . . 1.78 107.816 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -123.37 67.98 1.0 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 106.564 -1.643 . . . . 0.25 106.564 177.445 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -10.44 15.33 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.934 -0.765 . . . . 0.22 108.934 -179.265 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -89.83 8.25 32.95 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.869 -0.789 . . . . 1.13 108.869 179.481 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.7 t -126.64 147.26 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 107.539 -1.282 . . . . 0.24 107.539 178.617 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -100.27 123.45 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.015 -1.053 . . . . 0.15 109.342 -178.658 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.539 ' C ' HD12 ' A' ' 55' ' ' LEU . 59.3 m-85 -106.09 123.96 48.83 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.136 -0.977 . . . . 0.12 109.689 179.569 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.539 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -110.0 140.16 44.31 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.077 -1.014 . . . . 0.22 109.652 178.936 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -109.93 131.45 55.05 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 106.942 -1.503 . . . . 1.13 106.942 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.79 135.25 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.428 -0.795 . . . . 0.15 110.576 -177.992 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 58' ' ' ASP . . . . . 0.639 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 53.8 t0 -97.49 119.71 36.53 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.19 -1.041 . . . . 1.05 108.19 179.186 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -68.38 -18.47 23.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.635 -1.291 . . . . 0.16 108.672 179.693 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.3 -40.76 10.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.384 -0.823 . . . . 1.08 111.505 -178.764 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.28 -13.69 23.18 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.717 -1.24 . . . . 1.07 108.106 179.516 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 62' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -125.59 37.83 4.29 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.426 -1.324 . . . . 0.14 107.426 179.164 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -59.7 -23.67 63.32 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.812 -0.81 . . . . 1.47 108.812 -178.757 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.2 p30 -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.979 -1.076 . . . . 1.05 108.757 178.811 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.469 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 4.5 t -71.18 -46.88 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 CA-C-O 121.619 0.723 . . . . 0.35 109.88 179.873 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.48 -37.14 68.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.668 -0.645 . . . . 0.26 110.597 -178.643 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -60.09 -37.43 79.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.154 -0.967 . . . . 0.24 109.466 -179.293 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.28 -33.92 76.83 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.401 -0.812 . . . . 2.06 109.099 179.163 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.92 0.45 53.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.504 -0.747 . . . . 0.23 110.402 -179.34 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.7 mp0 53.14 50.05 18.63 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 2.02 110.379 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.4 t -67.99 134.41 30.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 O-C-N 120.59 -1.319 . . . . 0.16 108.74 -179.897 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -105.21 -12.94 15.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.548 -0.72 . . . . 1.6 109.844 -179.609 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.511 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.96 158.22 19.42 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.925 -1.11 . . . . 0.14 110.584 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 36.9 p -129.94 155.29 80.82 Favored Pre-proline 0 N--CA 1.502 2.169 0 N-CA-C 108.494 -0.928 . . . . 0.15 108.494 179.248 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -75.14 140.15 65.57 Favored 'Cis proline' 0 N--CA 1.497 1.734 0 C-N-CA 123.871 -1.304 . . . . 0.16 113.157 -2.112 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 90.0 m -125.39 130.34 51.69 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.263 -1.014 . . . . 0.13 108.263 178.163 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 77' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 91.9 m-85 -109.16 131.16 55.33 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 108.669 -0.863 . . . . 0.2 108.669 -179.529 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 23.7 mt-30 -123.0 141.91 51.43 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.347 -0.845 . . . . 0.29 108.743 179.764 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 79' ' ' PHE . . . . . 0.439 ' CE2' HG22 ' A' ' 24' ' ' VAL . 71.8 m-85 -108.1 135.12 49.99 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.558 0.694 . . . . 0.14 110.741 -179.001 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -129.87 143.57 50.87 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.125 -0.695 . . . . 0.15 109.125 179.253 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -147.19 130.98 17.0 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 107.167 -1.42 . . . . 1.68 107.167 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 70.5 mttt 58.83 26.1 14.39 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.697 -0.853 . . . . 1.22 108.697 -178.403 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.15 22.13 71.83 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.949 -1.26 . . . . 0.23 109.949 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 89.6 mt-30 -129.71 141.52 50.88 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.356 -1.085 . . . . 2.07 110.406 -179.845 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -79.39 125.47 29.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.271 -0.893 . . . . 1.82 109.466 179.664 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 m -123.66 11.24 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.763 -0.586 . . . . 0.3 110.296 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.51 157.98 20.87 Favored Glycine 0 N--CA 1.497 2.701 0 C-N-CA 118.602 -1.761 . . . . 0.17 111.523 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 88' ' ' GLU . . . . . 0.472 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.1 tp10 -167.23 148.64 5.75 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.775 -0.838 . . . . 1.93 109.146 179.578 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.472 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.5 p90 -169.28 156.93 7.23 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.504 -0.748 . . . . 0.14 109.936 178.108 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.3 p -126.48 163.63 22.92 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.484 -0.76 . . . . 0.12 109.646 -179.588 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.481 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.85 142.48 6.69 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.324 -1.511 . . . . 0.12 109.324 179.836 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 92' ' ' ALA . . . . . 0.459 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.68 65.67 3.22 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.316 -1.108 . . . . 0.18 110.1 -179.542 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 50.6 t-20 -119.04 96.03 5.06 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.367 -0.975 . . . . 0.88 108.367 178.653 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -32.34 72.25 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 1.06 111.373 -179.287 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.36 -30.05 70.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.829 -1.17 . . . . 1.61 109.765 -179.566 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.42 -34.19 73.59 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.07 -0.715 . . . . 1.45 109.07 -179.035 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.91 -39.38 85.2 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.158 0.98 . . . . 0.19 108.571 179.226 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -60.68 -44.02 97.0 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 120.174 -0.61 . . . . 2.1 110.826 -178.324 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.62 -44.02 71.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.19 111.603 -178.203 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.0 m -64.0 -39.92 95.19 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 120.853 -1.154 . . . . 0.2 109.683 -178.864 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.84 -49.48 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 N-CA-C 108.077 -1.083 . . . . 0.16 108.077 178.876 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.519 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.2 t-20 -60.18 -35.23 74.9 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.257 -1.016 . . . . 0.95 108.257 179.166 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -68.0 -40.07 83.09 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.436 -0.79 . . . . 2.21 110.616 -179.188 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.683 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.4 mt -98.78 -3.44 35.61 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.232 -0.917 . . . . 0.25 111.185 -178.533 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.519 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.5 p . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.589 -1.319 . . . . 1.08 109.105 -179.758 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo . . . . . 0 N--CA 1.495 1.616 0 CA-C-O 120.983 0.326 . . . . 1.46 112.383 . . . . . . . . . 0 0 . 1 . 034 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.05 129.85 34.8 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.074 -1.016 . . . . 0.88 108.705 179.268 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 24.1 m -98.07 120.12 37.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.955 . . . . 0.7 109.833 -179.376 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.1 mt -71.87 -24.16 61.63 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.415 -0.803 . . . . 0.61 109.863 179.36 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.6 -17.71 64.97 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.314 -0.866 . . . . 1.31 109.692 -178.532 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.481 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.8 mm -130.02 142.01 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.677 -0.639 . . . . 0.15 109.856 -179.208 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.5 m -101.27 129.28 47.21 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.538 -1.282 . . . . 0.19 107.538 177.961 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 58.5 m -78.72 140.61 38.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.851 -1.156 . . . . 0.2 110.644 -178.897 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.448 ' C ' ' N ' ' B' ' 69' ' ' VAL . 18.5 m95 -76.15 -10.11 59.16 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.801 -1.187 . . . . 0.21 109.566 178.972 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 47.0 m-20 -51.85 -13.7 0.3 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.184 -0.947 . . . . 0.49 108.558 -179.683 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.448 ' N ' ' C ' ' B' ' 67' ' ' TRP . 14.0 m -60.49 145.97 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.744 -0.835 . . . . 1.04 108.744 179.093 . . . . . . . . 2 2 . 1 . 034 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -60.04 -37.73 80.65 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.042 -1.036 . . . . 1.36 109.532 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.311 -1.516 . . . . 2.32 109.311 -179.594 . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.0 mmt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.359 0.6 . . . . 2.88 109.693 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.1 t -120.21 155.54 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.229 0 N-CA-C 109.206 -0.665 . . . . 0.45 109.206 179.935 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -130.06 128.87 42.82 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.524 -0.917 . . . . 1.67 108.524 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -97.66 124.33 41.92 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.177 -0.952 . . . . 0.31 108.699 179.679 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -103.27 113.81 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 N-CA-C 108.787 -0.82 . . . . 0.19 108.787 179.426 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.3 mp0 -96.09 -1.05 49.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.993 . . . . 2.25 110.092 -179.463 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -155.49 156.66 35.63 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.885 -1.135 . . . . 0.15 111.376 -179.816 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 8' ' ' LYS . . . . . 0.725 ' HZ1' ' HB2' ' A' ' 68' ' ' GLU . 14.5 ttmm -64.08 -31.96 73.35 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.456 -0.942 . . . . 1.65 108.456 178.658 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.0 m -56.72 -49.07 76.27 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.276 -0.97 . . . . 0.23 108.559 -179.478 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -30.72 69.01 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.48 -0.763 . . . . 0.17 109.21 178.782 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 11' ' ' PHE . . . . . 0.491 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.5 t80 -59.67 -42.53 93.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.14 108.875 -179.354 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -65.77 -42.5 90.77 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.31 -0.996 . . . . 1.31 108.31 179.533 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -64.27 -37.33 87.09 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.285 0.564 . . . . 1.77 110.173 179.497 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.95 77.75 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.266 -0.896 . . . . 0.15 108.986 -179.477 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 15' ' ' LEU . . . . . 0.491 HD11 ' CE2' ' A' ' 11' ' ' PHE . 54.6 mt -60.72 -40.79 93.66 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.516 -0.873 . . . . 0.17 108.668 179.908 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -68.66 -38.1 80.15 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 1.07 110.238 179.573 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.81 -37.31 84.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.347 -0.845 . . . . 0.18 110.201 -178.694 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.83 73.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.026 -1.046 . . . . 0.17 109.385 179.893 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -124.48 22.48 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.897 -1.281 . . . . 0.2 109.897 -179.6 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.24 4.48 52.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.398 -1.06 . . . . 1.07 110.149 -179.206 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -75.79 147.74 38.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.973 -1.079 . . . . 1.5 108.848 -179.673 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.716 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.51 159.56 6.3 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 107.387 -1.338 . . . . 0.47 107.387 -179.392 . . . . . . . . 3 3 . 1 . 035 nuclear build full ' A' A ' 23' ' ' VAL . . . . . 0.716 ' H ' HD23 ' A' ' 22' ' ' LEU . 67.1 t -148.48 118.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 120.964 -1.085 . . . . 0.17 108.097 179.578 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 t -106.48 142.73 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.912 -1.144 . . . . 0.14 107.912 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.0 t -125.92 122.46 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.414 -0.804 . . . . 0.13 109.82 -178.76 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -99.09 118.85 36.77 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.303 -0.873 . . . . 1.05 109.456 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -94.79 20.49 8.66 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.155 -0.966 . . . . 0.73 109.285 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -55.94 147.87 18.56 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 120.974 -1.079 . . . . 0.3 110.276 -178.623 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.713 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.51 126.03 32.93 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.398 -1.334 . . . . 0.22 107.398 178.61 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -69.07 -32.02 71.17 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.661 -1.215 . . . . 0.3 107.829 179.395 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 31' ' ' TRP . . . . . 0.713 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 62.8 p-90 -70.42 -22.42 62.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.69 -0.631 . . . . 0.26 110.98 179.81 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.2 t -84.74 115.33 22.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.788 -1.195 . . . . 0.26 108.239 -179.772 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 33' ' ' GLY . . . . . 0.445 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.29 -51.89 55.16 Favored Glycine 0 N--CA 1.488 2.15 0 C-N-CA 120.437 -0.887 . . . . 0.23 111.391 -178.397 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.2 Cg_exo -51.81 -35.45 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 CA-C-N 118.809 1.305 . . . . 0.31 111.325 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.98 -50.29 13.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.531 -0.731 . . . . 0.24 110.09 -179.747 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -59.81 -34.95 73.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.086 -1.009 . . . . 1.59 109.026 -179.765 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 37' ' ' MET . . . . . 0.54 ' SD ' ' O ' ' A' ' 37' ' ' MET . 10.1 tmm? -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.403 -0.81 . . . . 2.1 109.313 179.917 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 38' ' ' ILE . . . . . 0.571 HG22 ' O ' ' A' ' 38' ' ' ILE . 74.9 mt -84.95 -1.99 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.588 -0.695 . . . . 0.49 111.603 -178.938 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 39' ' ' LYS . . . . . 0.574 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 18.2 pttt -65.44 -30.11 3.82 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 120.168 -1.582 . . . . 0.8 113.26 -178.627 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 40' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.2 Cg_exo -55.08 -40.06 87.76 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 121.403 1.537 . . . . 0.28 112.533 -177.067 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.26 -45.04 74.24 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 118.367 -1.333 . . . . 0.37 108.35 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.13 -51.63 67.08 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.21 -0.931 . . . . 0.16 109.697 179.36 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -67.33 -41.84 84.59 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.524 0.678 . . . . 0.32 110.741 179.841 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.3 m -62.22 -39.94 94.44 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.273 -0.892 . . . . 0.22 110.195 -179.287 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.74 -23.14 64.72 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.344 -0.848 . . . . 0.22 110.613 -179.023 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.2 m -53.36 -35.38 60.2 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.801 -1.187 . . . . 0.16 108.849 -179.254 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 47' ' ' GLU . . . . . 0.534 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.3 mp0 -88.88 -13.38 39.31 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.195 -0.941 . . . . 2.16 108.959 179.198 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -77.77 -39.97 42.37 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.814 -1.18 . . . . 1.78 107.814 178.698 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -123.87 69.6 1.06 Allowed 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.741 -1.577 . . . . 0.25 106.741 178.058 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.35 -9.07 10.41 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.543 -0.91 . . . . 0.22 108.543 -179.32 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -89.68 8.03 33.66 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.202 -1.036 . . . . 1.13 108.202 179.146 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 52' ' ' VAL . . . . . 0.47 HG13 ' HB3' ' A' ' 22' ' ' LEU . 56.0 t -126.45 142.74 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 N-CA-C 107.996 -1.113 . . . . 0.24 107.996 179.114 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 53' ' ' ILE . . . . . 0.427 HG22 ' CD1' ' A' ' 55' ' ' LEU . 30.7 mm -97.88 121.31 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.217 -0.927 . . . . 0.15 109.65 -178.995 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 54' ' ' PHE . . . . . 0.524 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.6 m-85 -101.63 125.4 48.28 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.391 -0.818 . . . . 0.12 109.385 179.551 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.524 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -110.28 144.85 38.37 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.075 -1.016 . . . . 0.22 110.097 179.14 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -112.52 131.51 55.56 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.216 -1.402 . . . . 1.13 107.216 177.825 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -128.21 132.08 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.404 -0.81 . . . . 0.15 109.744 -178.849 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -95.11 120.0 34.57 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.872 -0.788 . . . . 1.05 108.872 179.873 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -64.99 -19.84 26.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.813 0 O-C-N 120.378 -1.451 . . . . 0.16 107.876 179.199 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 60' ' ' ASP . . . . . 0.499 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 28.5 m-20 -92.64 -41.67 10.06 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.457 -0.777 . . . . 1.08 112.403 -178.746 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -95.67 -18.23 20.67 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.36 -1.463 . . . . 1.07 108.99 -179.576 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.82 40.7 3.66 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.735 -1.209 . . . . 0.14 107.735 179.029 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -60.18 -19.13 52.63 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.469 -0.567 . . . . 1.47 109.469 -179.161 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 64' ' ' ASP . . . . . 0.59 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -62.22 -39.43 92.76 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.985 -1.072 . . . . 1.05 108.849 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 65' ' ' VAL . . . . . 0.59 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.2 t -73.69 -43.98 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 O-C-N 121.274 -0.891 . . . . 0.35 109.849 -179.973 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.37 -40.57 81.39 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.396 -0.815 . . . . 0.26 110.471 -178.273 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.6 p -60.32 -39.29 86.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.048 -1.032 . . . . 0.24 109.177 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 68' ' ' GLU . . . . . 0.725 ' HB2' ' HZ1' ' A' ' 8' ' ' LYS . 40.4 tt0 -62.97 -38.99 93.34 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.337 -0.852 . . . . 2.06 109.832 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.68 -2.5 58.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.437 -0.789 . . . . 0.23 111.179 -178.416 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 56.03 49.15 16.26 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.163 -0.96 . . . . 2.02 109.947 -179.913 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.84 132.47 28.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 118.586 -1.246 . . . . 0.16 108.038 -179.617 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -105.26 -12.17 16.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.478 -0.764 . . . . 1.6 110.173 -179.039 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 73' ' ' ALA . . . . . 0.465 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.86 156.22 17.44 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.829 -1.169 . . . . 0.14 111.071 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -127.72 156.28 75.89 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 107.966 -1.124 . . . . 0.15 107.966 179.087 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -74.36 143.39 77.68 Favored 'Cis proline' 0 N--CA 1.494 1.547 0 C-N-CA 123.85 -1.312 . . . . 0.16 112.851 -3.682 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 76' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -128.24 133.7 48.87 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.492 -0.929 . . . . 0.13 108.492 177.926 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -111.46 131.69 55.03 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 108.803 -0.814 . . . . 0.2 108.803 -179.236 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -122.96 140.61 52.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.29 109.161 179.457 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -108.28 135.55 49.42 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.309 0.576 . . . . 0.14 110.448 -179.207 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -126.32 149.16 49.35 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.43 0.633 . . . . 0.15 109.434 179.341 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -146.76 126.41 13.37 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 106.964 -1.495 . . . . 1.68 106.964 -179.734 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.9 mttp 54.02 34.08 18.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.938 -1.101 . . . . 1.22 108.677 -177.987 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.64 20.71 79.72 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 110.017 -1.233 . . . . 0.23 110.017 179.568 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 40.9 mm-40 -124.45 133.5 53.35 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.427 -1.043 . . . . 2.07 110.611 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -78.4 124.06 27.69 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.241 -0.912 . . . . 1.82 109.732 179.657 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.4 m -123.99 10.8 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.663 -0.648 . . . . 0.3 110.522 -179.578 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.83 151.26 10.6 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 118.564 -1.779 . . . . 0.17 111.451 -179.819 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -164.92 148.01 8.48 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.815 -0.815 . . . . 1.93 109.045 179.285 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 89' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 11.1 p90 -164.19 159.03 19.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.198 -0.939 . . . . 0.14 110.025 178.16 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.24 159.98 31.56 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.58 0.705 . . . . 0.12 109.786 -179.529 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 91' ' ' GLY . . . . . 0.474 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.37 143.0 6.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.241 -1.544 . . . . 0.12 109.241 179.099 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.39 66.58 2.47 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.258 -1.142 . . . . 0.18 109.606 -179.879 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 49.5 t-20 -119.84 92.51 3.8 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 108.175 -1.046 . . . . 0.88 108.175 178.909 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.97 -32.53 73.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.445 -0.784 . . . . 1.06 111.196 -179.093 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -63.92 -30.8 71.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.035 -1.041 . . . . 1.61 109.521 -179.619 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.36 -35.33 75.44 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 109.215 -0.661 . . . . 1.45 109.215 -179.003 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.86 -38.88 83.38 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.562 -0.903 . . . . 0.19 108.562 179.106 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.47 -43.75 98.31 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 120.261 -0.576 . . . . 2.1 110.673 -178.029 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.88 -43.81 71.07 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.211 -0.931 . . . . 0.19 111.543 -178.768 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -64.17 -39.93 95.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.868 -1.145 . . . . 0.2 110.18 -178.585 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.3 mt -61.39 -48.97 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 108.162 -1.051 . . . . 0.16 108.162 179.118 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 102' ' ' ASN . . . . . 0.51 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.1 t-20 -60.63 -34.62 74.55 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.389 -0.967 . . . . 0.95 108.389 179.448 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -68.03 -39.93 83.02 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.532 -0.73 . . . . 2.21 110.909 -178.587 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' A' A ' 104' ' ' LEU . . . . . 0.505 ' HB2' HD11 ' A' ' 22' ' ' LEU . 88.0 mt -100.17 0.22 40.09 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.108 -0.995 . . . . 0.25 111.141 -178.333 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' A' A ' 105' ' ' VAL . . . . . 0.51 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.683 -1.26 . . . . 1.08 109.464 -179.489 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo . . . . . 0 N--CA 1.495 1.574 0 CA-C-O 121.055 0.356 . . . . 1.46 111.865 . . . . . . . . . 0 0 . 1 . 035 nuclear build full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.45 121.95 30.55 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 0.88 108.498 179.658 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 61' ' ' THR . . . . . 0.47 HG22 ' H ' ' B' ' 63' ' ' LYS . 22.7 m -107.44 125.88 51.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.461 -0.774 . . . . 0.7 109.844 -179.082 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.01 -23.6 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.447 -0.783 . . . . 0.61 109.788 179.702 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 63' ' ' LYS . . . . . 0.47 ' H ' HG22 ' B' ' 61' ' ' THR . 65.8 mmtt -60.79 -16.43 40.5 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.497 -0.752 . . . . 1.31 109.132 -178.914 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 64' ' ' ILE . . . . . 0.474 HD11 ' HA2' ' A' ' 91' ' ' GLY . 28.9 mm -135.85 142.43 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 N-CA-C 109.406 -0.59 . . . . 0.15 109.406 -179.649 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 9.4 m -101.71 127.2 48.58 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 107.543 -1.28 . . . . 0.19 107.543 177.634 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 66' ' ' SER . . . . . 0.431 ' O ' HG23 ' B' ' 69' ' ' VAL . 65.1 m -78.81 139.94 38.29 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.865 -1.147 . . . . 0.2 111.562 -178.291 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 67' ' ' TRP . . . . . 0.504 ' O ' ' N ' ' B' ' 69' ' ' VAL . 24.0 m95 -72.94 -8.75 57.08 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.912 -0.773 . . . . 0.21 108.912 178.283 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 35.1 m-20 -49.94 -10.59 0.05 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.794 -0.817 . . . . 0.49 108.794 179.37 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 69' ' ' VAL . . . . . 0.504 ' N ' ' O ' ' B' ' 67' ' ' TRP . 4.7 t -42.4 153.22 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.431 -0.793 . . . . 1.04 110.135 -179.446 . . . . . . . . 2 2 . 1 . 035 nuclear build full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -60.25 -39.61 87.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 1.36 109.086 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear build full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 CA-C-O 118.042 -1.421 . . . . 2.32 109.825 -179.855 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 81.3 tttt . . . . . 0 N--CA 1.497 1.922 0 N-CA-C 109.296 -0.631 . . . . 1.67 109.296 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -94.64 123.22 37.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.31 108.748 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.9 mm -99.87 116.47 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.896 -1.15 . . . . 0.19 107.896 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.516 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 55.1 mp0 -99.48 -1.08 39.36 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.34 -0.85 . . . . 2.25 109.274 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -155.74 156.49 34.94 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.988 -1.07 . . . . 0.15 111.481 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -63.34 -31.45 72.61 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.332 -0.988 . . . . 1.65 108.332 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 87.1 m -59.51 -47.52 85.22 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.729 -0.841 . . . . 0.23 108.729 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -30.5 69.8 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.381 -0.825 . . . . 0.17 108.909 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.477 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.5 t80 -59.81 -41.42 91.21 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.378 -0.826 . . . . 0.14 109.276 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -66.78 -41.88 86.97 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.769 -0.826 . . . . 1.31 108.769 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.27 -40.45 93.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.825 -0.547 . . . . 1.77 110.686 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.27 87.38 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.244 -0.91 . . . . 0.15 109.278 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.477 HD11 ' CE2' ' A' ' 11' ' ' PHE . 70.8 mt -61.71 -39.95 93.33 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.868 -1.145 . . . . 0.17 108.574 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.99 -35.32 74.32 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.641 -0.662 . . . . 1.07 109.945 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.1 -36.48 79.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.24 -0.912 . . . . 0.18 109.901 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.4 -33.06 74.72 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 0.17 109.455 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.92 -127.28 24.82 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 109.583 -1.407 . . . . 0.2 109.583 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.446 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 69.2 m-20 -90.02 2.17 55.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.258 . . . . 1.07 110.456 -178.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -75.22 150.09 38.72 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.906 -1.121 . . . . 1.5 110.171 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.658 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.6 155.21 15.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 107.395 -1.335 . . . . 0.47 107.395 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.656 ' H ' HD23 ' A' ' 22' ' ' LEU . 89.5 t -142.38 110.43 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.187 -0.946 . . . . 0.17 108.954 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.1 t -97.37 142.58 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 N-CA-C 108.28 -1.007 . . . . 0.14 108.28 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.1 t -124.48 124.61 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.191 -0.943 . . . . 0.13 109.49 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.531 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -101.97 118.17 36.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.488 -0.757 . . . . 1.05 109.963 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.487 ' CE2' ' NE2' ' A' ' 78' ' ' GLN . 67.0 m-85 -95.8 21.63 8.28 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.288 -0.882 . . . . 0.73 109.531 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -57.5 148.59 23.3 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.926 -1.109 . . . . 0.3 110.697 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.668 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.04 123.93 32.66 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.054 -1.091 . . . . 0.22 108.054 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.6 t -67.94 -31.38 71.1 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.783 -1.167 . . . . 0.3 108.303 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.668 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.9 p-90 -71.05 -24.27 62.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.578 -0.701 . . . . 0.26 110.645 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -85.18 119.31 25.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.942 -1.098 . . . . 0.26 108.101 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.438 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.31 -53.22 47.37 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 111.134 -0.786 . . . . 0.23 111.134 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.6 Cg_exo -53.05 -37.16 78.68 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 CA-C-N 118.515 1.158 . . . . 0.31 112.344 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.6 6.63 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.487 -0.758 . . . . 0.24 110.083 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.84 -36.74 77.46 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.01 -1.056 . . . . 1.59 109.813 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.513 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.11 -29.73 67.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -0.798 . . . . 2.1 110.244 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.62 HG22 ' O ' ' A' ' 38' ' ' ILE . 52.3 mt -83.89 0.45 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.439 -0.788 . . . . 0.49 110.999 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.566 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 12.9 ptmt -68.03 -28.52 1.89 Allowed Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 120.57 -1.331 . . . . 0.8 113.406 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.566 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.3 Cg_exo -53.03 -39.61 79.06 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 CA-C-N 121.857 1.699 . . . . 0.28 112.92 -176.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -69.13 -45.17 70.78 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 118.438 -1.305 . . . . 0.37 108.735 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -60.21 -52.97 63.05 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.132 -0.98 . . . . 0.16 109.694 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -68.71 -44.25 74.28 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.623 -0.673 . . . . 0.32 110.726 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 54.4 m -60.64 -39.7 89.26 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.059 -1.026 . . . . 0.22 111.186 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -64.53 -19.65 65.73 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.963 -1.086 . . . . 0.22 110.945 -177.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -49.87 -39.84 40.68 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.902 -1.124 . . . . 0.16 108.66 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -84.53 -13.82 50.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.69 -1.257 . . . . 2.16 109.485 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -76.44 -36.29 58.04 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.613 -1.254 . . . . 1.78 107.613 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -125.85 68.88 1.18 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.023 -1.473 . . . . 0.25 107.023 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -64.28 -7.95 11.16 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.509 -0.745 . . . . 0.22 109.113 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -91.48 8.99 33.74 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.898 -1.149 . . . . 1.13 107.898 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 38.8 t -128.0 141.82 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 107.875 -1.157 . . . . 0.24 107.875 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -99.62 121.55 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.189 -0.945 . . . . 0.15 109.708 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.513 ' C ' HD12 ' A' ' 55' ' ' LEU . 40.7 m-85 -101.19 127.51 47.72 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.272 -0.893 . . . . 0.12 109.869 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -109.89 141.03 43.18 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.306 -0.871 . . . . 0.22 108.812 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -109.51 131.24 55.25 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 106.677 -1.601 . . . . 1.13 106.677 177.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -128.67 131.99 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.438 -0.789 . . . . 0.15 110.638 -177.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.615 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 40.2 t0 -96.01 120.12 35.73 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.828 -0.804 . . . . 1.05 108.828 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.5 m -67.89 -19.03 24.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 O-C-N 120.456 -1.402 . . . . 0.16 108.513 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.492 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 12.0 m-20 -92.58 -44.22 8.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.377 -0.827 . . . . 1.08 111.529 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.429 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 69.4 m-20 -94.23 -15.16 24.81 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.757 -1.214 . . . . 1.07 108.259 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.88 4.09 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.023 -1.102 . . . . 0.14 108.023 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -60.09 -26.54 66.28 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.59 -0.694 . . . . 1.47 110.35 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.513 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -64.1 -37.91 89.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.785 -1.197 . . . . 1.05 108.952 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.513 HG23 ' OD1' ' A' ' 64' ' ' ASP . 4.4 t -70.31 -44.24 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 121.275 -0.891 . . . . 0.35 109.249 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.8 -40.31 76.03 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.763 -0.586 . . . . 0.26 110.341 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.7 p -61.14 -33.59 73.64 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.199 -0.938 . . . . 0.24 109.222 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -60.36 -39.58 87.69 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.254 -0.904 . . . . 2.06 108.791 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.465 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -89.82 -1.49 58.0 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.349 -0.844 . . . . 0.23 110.913 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 55.68 49.92 15.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.183 -0.948 . . . . 2.02 109.605 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.7 t -61.52 128.9 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 120.663 -1.273 . . . . 0.16 109.021 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -101.34 -10.91 19.85 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.712 -0.618 . . . . 1.6 110.045 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.474 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.61 155.99 17.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.689 -1.257 . . . . 0.14 110.459 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 33.9 p -129.22 154.05 80.51 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.075 -1.083 . . . . 0.15 108.075 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -75.53 141.65 71.79 Favored 'Cis proline' 0 N--CA 1.495 1.595 0 C-N-CA 123.862 -1.307 . . . . 0.16 113.148 -1.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.75 131.61 47.87 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.544 -0.91 . . . . 0.13 108.544 178.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.531 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.6 m-85 -108.82 130.65 55.4 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 109.001 -0.74 . . . . 0.2 109.001 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.487 ' NE2' ' CE2' ' A' ' 27' ' ' PHE . 70.9 mt-30 -122.81 140.48 52.88 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.247 -0.908 . . . . 0.29 108.601 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.404 ' CE1' HG21 ' A' ' 100' ' ' THR . 74.2 m-85 -107.78 136.03 48.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.762 -0.586 . . . . 0.14 110.228 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -127.1 149.22 50.04 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.023 -0.732 . . . . 0.15 109.023 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -145.77 120.48 9.85 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.772 -1.196 . . . . 1.68 107.772 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.446 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 52.8 mttm 59.38 30.73 20.48 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.629 -1.248 . . . . 1.22 107.629 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.21 15.79 81.17 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.654 -1.378 . . . . 0.23 109.654 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -114.53 131.64 56.59 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.461 -1.023 . . . . 2.07 110.574 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -77.93 120.13 22.36 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.211 -0.93 . . . . 1.82 108.913 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.9 m -122.85 12.45 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.512 -0.742 . . . . 0.3 111.025 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.82 151.17 9.36 Favored Glycine 0 N--CA 1.49 2.297 0 C-N-CA 118.445 -1.836 . . . . 0.17 110.992 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.5 tm-20 -164.34 149.57 10.24 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.833 -0.804 . . . . 1.93 109.207 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 13.1 p90 -164.04 160.14 21.4 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.063 -1.055 . . . . 0.14 109.338 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.24 161.72 27.08 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.49 0.662 . . . . 0.12 109.749 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.456 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.98 141.04 5.82 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.542 -1.423 . . . . 0.12 109.542 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.496 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.06 66.4 2.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.18 109.903 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.11 94.21 4.31 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.51 -0.744 . . . . 0.88 109.51 178.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -31.64 72.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.062 -1.024 . . . . 1.06 111.539 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.99 -30.37 70.91 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.612 -1.305 . . . . 1.61 109.806 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -59.92 -34.33 73.06 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.627 0.727 . . . . 1.45 109.837 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.59 -39.09 83.01 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 122.046 0.927 . . . . 0.19 108.693 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.42 -44.19 97.04 Favored 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 120.111 -0.636 . . . . 2.1 110.4 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.57 -43.29 69.74 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.22 -0.925 . . . . 0.19 111.365 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.404 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.6 m -64.56 -40.37 95.45 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.978 -1.076 . . . . 0.2 108.939 -178.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.6 mt -61.29 -46.08 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 106.843 -1.54 . . . . 0.16 106.843 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.5 ' O ' HG12 ' A' ' 105' ' ' VAL . 16.9 t-20 -60.48 -35.82 76.82 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.748 -0.834 . . . . 0.95 108.748 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -68.57 -39.95 80.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.547 -0.721 . . . . 2.21 110.111 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.658 ' HB2' HD11 ' A' ' 22' ' ' LEU . 80.2 mt -98.96 -0.09 42.88 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.107 -0.995 . . . . 0.25 111.624 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.619 -1.3 . . . . 1.08 109.682 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 47.9 mmtm . . . . . 0 N--CA 1.489 1.479 0 N-CA-C 109.509 -0.552 . . . . 1.31 109.509 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.456 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.9 mm -128.99 141.19 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.737 -0.602 . . . . 0.15 109.844 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.4 m -100.48 128.47 46.53 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.616 -1.624 . . . . 0.19 106.616 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -82.37 143.01 31.53 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.72 -1.238 . . . . 0.2 111.724 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.428 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.1 m95 -76.25 -13.31 60.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.565 -0.709 . . . . 0.21 109.33 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 . . . . . 0 N--CA 1.49 1.538 0 N-CA-C 107.865 -1.161 . . . . 0.49 107.865 179.852 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.1 tttp . . . . . 0 N--CA 1.5 2.027 0 N-CA-C 109.476 -0.564 . . . . 1.67 109.476 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -95.27 124.73 39.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.242 -0.911 . . . . 0.31 109.301 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mm -101.47 116.39 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.288 -1.004 . . . . 0.19 108.288 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -98.55 -3.54 36.16 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.009 -1.057 . . . . 2.25 109.721 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -152.26 159.93 43.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.863 -1.148 . . . . 0.15 110.975 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -63.98 -34.33 77.75 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.83 -1.174 . . . . 1.65 107.83 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -56.61 -46.22 81.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.49 -0.929 . . . . 0.23 108.49 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.56 -31.0 68.92 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.652 -0.87 . . . . 0.17 108.652 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.537 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.5 t80 -60.03 -43.3 95.4 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.105 -0.997 . . . . 0.14 108.936 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -66.56 -43.19 85.72 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.915 -0.772 . . . . 1.31 108.915 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -62.49 -40.72 97.59 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.583 -0.698 . . . . 1.77 110.622 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.11 -40.33 86.84 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.85 -1.157 . . . . 0.15 108.684 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 11' ' ' PHE . 79.8 mt -60.76 -40.86 94.03 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.17 108.203 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -70.08 -34.5 73.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.318 -0.864 . . . . 1.07 109.592 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.8 75.18 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.643 -0.661 . . . . 0.18 110.202 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.09 71.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.185 -0.947 . . . . 0.17 109.71 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.78 -127.57 25.51 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 110.455 -1.058 . . . . 0.2 110.455 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -90.79 2.42 56.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.918 -1.342 . . . . 1.07 110.307 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.5 mttt -74.05 150.69 40.47 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.005 -1.059 . . . . 1.5 110.011 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.649 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.29 156.45 15.57 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.287 -1.375 . . . . 0.47 107.287 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.649 ' H ' HD23 ' A' ' 22' ' ' LEU . 65.6 t -143.97 111.54 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.75 -1.219 . . . . 0.17 109.483 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.4 t -100.69 141.47 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 108.046 -1.094 . . . . 0.14 108.046 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.9 t -124.64 121.51 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.307 -0.871 . . . . 0.13 109.622 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -98.71 121.13 40.26 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.307 -0.871 . . . . 1.05 109.917 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.24 19.69 11.51 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.963 -1.086 . . . . 0.73 110.129 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.443 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.2 m -54.3 143.29 23.7 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.047 -1.033 . . . . 0.3 110.595 -178.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.506 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -81.0 129.43 34.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.031 -1.1 . . . . 0.22 108.031 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -68.62 -32.29 72.06 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.987 -1.07 . . . . 0.3 108.997 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.509 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 54.4 p-90 -73.59 -21.54 60.3 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.598 -0.841 . . . . 0.26 110.803 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.8 t -84.66 113.14 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.099 -1.001 . . . . 0.26 108.594 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.435 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.26 -51.99 55.41 Favored Glycine 0 N--CA 1.486 2.007 0 C-N-CA 120.698 -0.763 . . . . 0.23 111.334 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 33.0 Cg_exo -50.31 -36.31 46.89 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 CA-C-N 119.002 1.401 . . . . 0.31 112.056 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.443 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.88 -46.19 19.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.39 -0.818 . . . . 0.24 109.148 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -59.28 -32.9 70.46 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.08 -1.013 . . . . 1.59 109.003 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.467 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.1 tmm? -59.15 -27.75 65.94 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.635 -0.666 . . . . 2.1 110.133 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.8 mt -83.58 -5.9 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.492 -0.755 . . . . 0.49 110.952 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.545 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.15 -31.56 9.56 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 119.62 -1.925 . . . . 0.8 113.32 -176.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.6 Cg_exo -59.68 -40.2 66.87 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 CA-C-N 121.347 1.517 . . . . 0.28 112.129 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.77 -1.172 . . . . 0.37 109.481 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -61.15 -50.63 72.42 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.229 -0.919 . . . . 0.16 109.317 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -67.99 -41.7 81.88 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-O 121.156 0.503 . . . . 0.32 110.974 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.2 m -64.72 -37.76 88.69 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.051 -1.031 . . . . 0.22 110.392 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.54 -23.67 67.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.444 -0.785 . . . . 0.22 110.62 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.9 m -53.14 -39.88 63.83 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.724 -1.235 . . . . 0.16 108.064 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -82.9 -17.77 42.54 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.421 -0.8 . . . . 2.16 109.292 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -75.65 -37.3 59.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.95 -1.5 . . . . 1.78 106.95 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -122.03 68.48 0.93 Allowed 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.977 -1.49 . . . . 0.25 106.977 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -63.59 -11.05 21.64 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.815 -0.809 . . . . 0.22 108.815 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -89.97 8.77 30.72 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.414 -0.958 . . . . 1.13 108.414 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.41 HG13 ' HB3' ' A' ' 22' ' ' LEU . 45.6 t -127.56 146.09 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.355 -0.98 . . . . 0.24 108.355 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -99.96 122.31 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.033 -1.042 . . . . 0.15 109.451 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.534 ' C ' HD12 ' A' ' 55' ' ' LEU . 46.9 m-85 -103.73 127.95 51.15 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.272 -0.892 . . . . 0.12 109.164 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 54' ' ' PHE . 3.8 mp -111.35 139.95 46.34 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.249 -0.907 . . . . 0.22 109.153 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -111.87 129.89 56.01 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 106.828 -1.545 . . . . 1.13 106.828 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.1 t -127.25 139.12 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.608 -0.682 . . . . 0.15 110.851 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.8 t0 -99.22 118.38 35.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.598 -0.89 . . . . 1.05 108.598 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.05 -18.41 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 120.257 -1.527 . . . . 0.16 108.608 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.509 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.8 m-20 -92.27 -43.11 9.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.494 -0.754 . . . . 1.08 111.566 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.458 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.2 m-20 -95.66 -16.66 21.88 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.719 -1.238 . . . . 1.07 108.701 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.1 37.78 4.29 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.632 -1.247 . . . . 0.14 107.632 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -59.93 -20.48 57.66 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 1.47 110.154 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.598 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -66.97 -36.77 82.94 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.969 -1.082 . . . . 1.05 108.464 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.598 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.9 t -72.45 -45.65 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.424 -0.798 . . . . 0.35 109.742 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.87 -36.65 70.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.542 -0.724 . . . . 0.26 111.328 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.1 p -60.47 -37.02 79.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.212 . . . . 0.24 109.184 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.6 -35.48 80.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.495 -0.753 . . . . 2.06 109.369 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.407 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -87.27 -1.29 57.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.383 -0.823 . . . . 0.23 110.772 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mp0 54.87 49.87 16.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.215 -0.928 . . . . 2.02 109.846 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.51 135.88 27.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 120.915 -1.116 . . . . 0.16 108.562 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -107.41 -15.46 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.71 -0.619 . . . . 1.6 109.836 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.5 154.49 22.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.897 -1.127 . . . . 0.14 111.333 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.444 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.5 p -124.52 155.7 68.71 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 107.954 -1.128 . . . . 0.15 107.954 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -77.22 141.39 68.53 Favored 'Cis proline' 0 N--CA 1.495 1.567 0 C-N-CA 123.769 -1.346 . . . . 0.16 113.025 -2.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.2 m -125.87 130.73 51.92 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.644 -0.872 . . . . 0.13 108.644 177.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -108.77 131.44 54.95 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.759 -0.83 . . . . 0.2 108.759 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.407 HE22 ' HB1' ' A' ' 69' ' ' ALA . 74.9 mt-30 -122.97 143.48 49.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.35 -0.982 . . . . 0.29 108.35 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -109.71 134.11 52.37 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.334 0.588 . . . . 0.14 110.594 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -126.83 148.76 49.95 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.406 -0.59 . . . . 0.15 109.406 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -147.2 127.61 14.02 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.926 -1.138 . . . . 1.68 107.926 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 53.48 33.58 16.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.91 -1.119 . . . . 1.22 108.296 -178.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.49 20.17 79.65 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.201 -1.16 . . . . 0.23 110.201 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -124.07 134.06 53.48 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.351 -1.088 . . . . 2.07 111.088 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -77.9 126.17 30.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.418 -0.801 . . . . 1.82 109.25 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.7 m -124.12 4.35 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.637 -0.664 . . . . 0.3 111.038 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.67 160.63 25.97 Favored Glycine 0 N--CA 1.496 2.669 0 C-N-CA 118.14 -1.981 . . . . 0.17 111.581 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -168.56 148.02 4.41 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 122.088 -0.654 . . . . 1.93 109.882 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -162.06 160.1 27.06 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.277 -0.889 . . . . 0.14 109.118 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -126.1 160.82 29.11 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.486 0.66 . . . . 0.12 109.991 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.471 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.36 143.28 6.44 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.014 -1.635 . . . . 0.12 109.014 179.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.4 65.71 3.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.044 -1.268 . . . . 0.18 109.877 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.06 97.07 5.62 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.622 -0.881 . . . . 0.88 108.622 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.44 -33.53 73.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.489 -0.757 . . . . 1.06 111.384 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.86 -29.97 71.1 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 1.61 109.239 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -60.53 -36.93 79.6 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-O 121.439 0.638 . . . . 1.45 109.51 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 53.9 mt -57.82 -39.75 78.38 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 122.084 0.945 . . . . 0.19 108.499 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -60.98 -43.43 98.82 Favored 'General case' 0 C--N 1.289 -2.047 0 C-N-CA 119.904 -0.718 . . . . 2.1 110.879 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.28 -43.86 76.81 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.206 -0.934 . . . . 0.19 111.507 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.5 m -65.3 -40.3 93.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.709 -1.244 . . . . 0.2 109.706 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.95 -49.58 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 N-CA-C 108.196 -1.039 . . . . 0.16 108.196 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.468 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.3 t-20 -60.29 -36.04 76.94 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.923 0.868 . . . . 0.95 108.678 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -67.44 -39.98 85.42 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.808 -0.558 . . . . 2.21 110.091 -178.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 22' ' ' LEU . 87.7 mt -100.88 2.61 41.09 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.299 -0.875 . . . . 0.25 111.17 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.7 p . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.423 -1.423 . . . . 1.08 109.263 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt . . . . . 0 N--CA 1.494 1.735 0 CA-C-O 120.67 0.271 . . . . 1.31 110.407 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.471 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.5 mm -129.91 139.91 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.672 -0.643 . . . . 0.15 109.424 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.0 m -101.03 132.05 46.63 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 106.88 -1.526 . . . . 0.19 106.88 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m -83.93 140.01 32.22 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.603 -1.311 . . . . 0.2 111.219 -177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.444 ' NE1' HG23 ' A' ' 74' ' ' THR . 20.6 m95 -73.15 -8.65 56.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.223 -0.923 . . . . 0.21 109.921 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.49 1.564 0 O-C-N 120.949 -1.095 . . . . 0.49 108.917 -179.976 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.6 tptt . . . . . 0 N--CA 1.496 1.87 0 N-CA-C 108.796 -0.816 . . . . 1.67 108.796 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -98.72 124.1 43.35 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 0.31 108.884 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -102.8 115.08 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 108.666 -0.864 . . . . 0.19 108.666 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -97.79 -0.05 45.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.16 -0.962 . . . . 2.25 110.173 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.12 154.22 34.36 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.869 -1.144 . . . . 0.15 111.01 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -63.64 -32.39 73.85 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.175 -1.046 . . . . 1.65 108.175 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 47.6 m -57.24 -48.43 78.85 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.179 -1.008 . . . . 0.23 108.596 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.75 -31.01 69.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.36 -0.837 . . . . 0.17 109.163 178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.529 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.1 t80 -59.45 -44.03 93.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.159 -0.963 . . . . 0.14 109.006 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -65.56 -40.88 93.33 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.705 -0.85 . . . . 1.31 108.705 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.34 -37.12 86.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.555 -0.716 . . . . 1.77 110.327 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.76 -42.34 81.91 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.327 -0.858 . . . . 0.15 109.054 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.529 HD11 ' CE2' ' A' ' 11' ' ' PHE . 55.0 mt -60.73 -40.35 92.04 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.609 -0.885 . . . . 0.17 108.609 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -70.04 -38.5 75.85 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.632 -0.667 . . . . 1.07 110.275 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.3 -37.38 80.58 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.254 -0.904 . . . . 0.18 109.988 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.85 69.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.204 -0.935 . . . . 0.17 109.303 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.03 -127.28 30.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.931 -1.268 . . . . 0.2 109.931 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -89.92 1.34 56.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.263 -1.139 . . . . 1.07 110.689 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttt -73.34 150.0 42.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.788 -1.195 . . . . 1.5 109.493 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.674 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.48 156.29 16.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 107.472 -1.307 . . . . 0.47 107.472 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.674 ' H ' HD23 ' A' ' 22' ' ' LEU . 84.4 t -143.34 111.33 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.132 -0.98 . . . . 0.17 108.992 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.89 140.57 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.135 -1.061 . . . . 0.14 108.135 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.53 123.96 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.325 -0.859 . . . . 0.13 109.249 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.523 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 27.4 t70 -102.32 118.43 36.87 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.465 -0.772 . . . . 1.05 109.692 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -95.42 23.15 6.18 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.197 -0.939 . . . . 0.73 109.974 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.1 m -59.13 145.7 41.47 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.742 -1.224 . . . . 0.3 110.078 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.724 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.74 126.87 32.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 107.957 -1.127 . . . . 0.22 107.957 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 t -68.08 -30.14 69.25 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.263 -1.014 . . . . 0.3 108.263 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.724 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.1 p-90 -76.44 -15.03 60.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.488 -0.757 . . . . 0.26 110.624 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.16 121.05 28.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.809 -1.182 . . . . 0.26 108.378 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -64.66 -53.62 33.83 Favored Glycine 0 N--CA 1.495 2.58 0 O-C-N 121.542 -0.724 . . . . 0.23 112.698 -177.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.5 Cg_endo -61.11 -29.92 88.16 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 CA-C-N 119.349 1.575 . . . . 0.31 112.279 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.22 17.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.155 -0.966 . . . . 0.24 109.442 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -59.75 -30.84 69.13 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.067 -1.021 . . . . 1.59 109.111 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' A' ' 37' ' ' MET . 13.8 tmm? -59.69 -28.4 67.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.643 -0.661 . . . . 2.1 109.498 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.6 mt -81.48 -4.13 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 O-C-N 121.545 -0.722 . . . . 0.49 111.179 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.21 -31.95 10.49 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 119.982 -1.699 . . . . 0.8 113.528 -177.063 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.9 Cg_exo -59.09 -39.84 75.99 Favored 'Trans proline' 0 N--CA 1.494 1.529 0 CA-C-N 121.387 1.531 . . . . 0.28 113.244 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -69.12 -49.22 59.03 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.504 -1.372 . . . . 0.37 108.849 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -59.99 -51.22 70.57 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.728 -0.842 . . . . 0.16 108.728 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 46.3 t60 -66.11 -44.14 85.16 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.897 -0.502 . . . . 0.32 110.985 179.399 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.5 m -63.24 -39.98 96.13 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.828 -1.17 . . . . 0.22 110.722 -179.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.02 -23.9 65.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.194 -0.941 . . . . 0.22 110.596 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -52.14 -40.19 61.01 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.84 -1.163 . . . . 0.16 108.602 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -84.66 -15.33 45.75 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.316 -0.865 . . . . 2.16 109.569 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -76.97 -38.08 53.95 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 107.502 -1.296 . . . . 1.78 107.502 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -121.64 68.0 0.91 Allowed 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 106.671 -1.603 . . . . 0.25 106.671 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 p -63.22 -9.88 13.18 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.384 -0.969 . . . . 0.22 108.384 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -90.23 9.75 27.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.129 -1.063 . . . . 1.13 108.129 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.3 t -127.85 143.94 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.861 -1.163 . . . . 0.24 107.861 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.6 mm -99.95 120.58 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 120.994 -1.066 . . . . 0.15 109.483 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.575 ' C ' HD12 ' A' ' 55' ' ' LEU . 51.9 m-85 -103.3 126.06 50.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.181 -0.949 . . . . 0.12 109.816 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.575 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -110.09 144.49 38.62 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.257 -0.902 . . . . 0.22 110.045 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -112.97 131.48 55.73 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.24 -1.393 . . . . 1.13 107.24 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.5 t -129.5 132.81 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.277 -0.89 . . . . 0.15 110.409 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.469 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 51.7 t0 -94.58 120.05 34.21 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.376 -0.827 . . . . 1.05 109.308 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.6 m -66.55 -18.17 23.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.478 -1.389 . . . . 0.16 108.156 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 16.1 m-20 -93.29 -44.79 8.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.441 -0.787 . . . . 1.08 112.264 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.443 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 78.9 m-20 -94.83 -13.61 25.38 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.554 -1.341 . . . . 1.07 108.91 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.4 37.88 4.31 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.542 -1.281 . . . . 0.14 107.542 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -60.12 -20.9 60.55 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.772 -0.58 . . . . 1.47 109.496 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.655 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -62.64 -36.96 84.51 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.929 -1.107 . . . . 1.05 108.473 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.655 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.4 t -73.31 -42.11 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.299 -0.876 . . . . 0.35 109.112 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.7 -41.43 79.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.392 -0.818 . . . . 0.26 111.083 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -59.99 -37.94 81.13 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.983 -1.073 . . . . 0.24 109.666 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -66.61 -37.93 85.92 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 2.06 109.507 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.56 -3.73 58.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.159 -0.963 . . . . 0.23 110.948 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 54.05 49.88 17.87 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.984 -1.073 . . . . 2.02 110.541 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.85 131.69 30.64 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.723 -1.236 . . . . 0.16 108.999 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -102.45 -10.73 19.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.572 -0.705 . . . . 1.6 110.655 -179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.504 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.97 154.27 17.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.607 -1.308 . . . . 0.14 111.136 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.409 HG23 ' NE1' ' B' ' 67' ' ' TRP . 34.4 p -127.36 154.12 77.17 Favored Pre-proline 0 N--CA 1.502 2.147 0 N-CA-C 107.585 -1.265 . . . . 0.15 107.585 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -75.97 141.64 71.25 Favored 'Cis proline' 0 N--CA 1.497 1.718 0 C-N-CA 124.172 -1.179 . . . . 0.16 113.006 -1.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 91.5 m -126.98 132.29 50.84 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 121.657 0.742 . . . . 0.13 109.26 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.701 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.2 m-85 -109.0 130.24 55.47 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.779 -0.823 . . . . 0.2 108.779 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -122.16 140.35 52.67 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.615 -0.883 . . . . 0.29 108.615 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -107.9 134.86 50.22 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.398 0.618 . . . . 0.14 110.186 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -129.19 146.04 51.2 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.288 0.566 . . . . 0.15 109.56 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -145.46 134.89 23.13 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 107.283 -1.376 . . . . 1.68 107.283 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.8 mttt 50.06 33.36 6.81 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.923 -1.11 . . . . 1.22 109.014 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.98 25.68 74.22 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.58 -1.408 . . . . 0.23 109.58 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -129.14 132.78 47.4 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.465 -1.02 . . . . 2.07 110.989 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.1 122.89 26.8 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.083 -0.71 . . . . 1.82 109.083 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.0 m -123.35 8.33 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.698 . . . . 0.3 110.433 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.44 153.86 14.35 Favored Glycine 0 N--CA 1.495 2.578 0 C-N-CA 118.344 -1.884 . . . . 0.17 111.82 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -166.05 149.11 7.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 122.033 -0.686 . . . . 1.93 109.56 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.43 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 19.9 p90 -163.66 163.66 24.22 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.279 -0.968 . . . . 0.14 109.339 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.91 160.34 31.3 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.504 0.669 . . . . 0.12 110.191 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.2 141.69 5.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.594 -1.402 . . . . 0.12 109.594 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.27 65.41 2.85 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.288 -1.125 . . . . 0.18 109.347 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.55 93.95 4.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.587 -0.894 . . . . 0.88 108.587 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.47 74.65 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.273 -0.892 . . . . 1.06 111.494 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.84 -29.79 70.95 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.758 -1.214 . . . . 1.61 109.307 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.43 ' NZ ' ' CD2' ' A' ' 89' ' ' PHE . 56.5 tttm -61.11 -34.75 75.46 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.558 -0.714 . . . . 1.45 109.215 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.701 HD21 ' CD1' ' A' ' 77' ' ' PHE . 38.6 mt -58.92 -38.91 80.03 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.967 -1.123 . . . . 0.19 107.967 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -61.93 -42.54 99.21 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.906 -0.718 . . . . 2.1 110.966 -178.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.75 -43.8 75.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.003 -1.061 . . . . 0.19 111.717 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.4 m -65.65 -39.63 91.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.694 -1.254 . . . . 0.2 110.055 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -60.92 -49.15 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.921 -1.112 . . . . 0.16 108.73 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 105' ' ' VAL . 21.6 t-20 -60.5 -35.52 76.13 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.151 -1.055 . . . . 0.95 108.151 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -67.45 -39.94 85.39 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 115.973 -0.558 . . . . 2.21 110.143 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.6 mt -99.23 -1.46 39.12 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.172 -0.955 . . . . 0.25 111.344 -178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 102' ' ' ASN . 4.9 p . . . . . 0 N--CA 1.498 1.97 0 O-C-N 120.49 -1.381 . . . . 1.08 109.426 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm . . . . . 0 N--CA 1.49 1.557 0 N-CA-C 109.459 -0.571 . . . . 1.31 109.459 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.445 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.6 mm -129.56 140.0 50.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.843 -0.535 . . . . 0.15 109.732 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -98.06 127.33 43.94 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 106.525 -1.658 . . . . 0.19 106.525 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.0 m -80.79 145.2 31.58 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.833 -1.167 . . . . 0.2 110.755 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.504 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.0 m95 -77.39 -9.94 59.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.133 -0.979 . . . . 0.21 108.815 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.489 1.496 0 O-C-N 121.355 -0.841 . . . . 0.49 108.762 179.73 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.3 tptt . . . . . 0 N--CA 1.499 1.998 0 N-CA-C 108.345 -0.983 . . . . 1.67 108.345 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.532 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 65.4 tt0 -96.75 124.26 40.68 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.421 -0.799 . . . . 0.31 108.944 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.8 mm -102.65 117.1 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 108.505 -0.924 . . . . 0.19 108.505 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.532 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 64.4 mm-40 -99.72 -2.51 35.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.289 -0.882 . . . . 2.25 109.888 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -155.15 157.27 37.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.185 -0.947 . . . . 0.15 111.115 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.191 -1.04 . . . . 1.65 108.191 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.4 m -55.84 -48.4 75.57 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.354 -0.938 . . . . 0.23 109.191 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.72 -30.33 67.93 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.254 -0.904 . . . . 0.17 109.218 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.5 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.3 t80 -58.88 -44.26 91.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.326 -0.859 . . . . 0.14 109.38 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -64.81 -42.31 95.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.308 -0.87 . . . . 1.31 109.151 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.534 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.55 -39.58 94.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.753 -0.592 . . . . 1.77 110.451 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.99 -41.1 87.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.234 -0.917 . . . . 0.15 109.12 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.5 HD11 ' CE2' ' A' ' 11' ' ' PHE . 77.8 mt -60.58 -40.42 91.67 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 108.11 -1.07 . . . . 0.17 108.11 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -69.09 -35.99 77.09 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.353 0.597 . . . . 1.07 110.416 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.4 79.58 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.271 -0.893 . . . . 0.18 109.541 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.15 -34.6 73.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.363 -0.836 . . . . 0.17 109.799 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.21 -125.65 21.66 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 110.019 -1.232 . . . . 0.2 110.019 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -90.86 2.41 56.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.237 -1.155 . . . . 1.07 110.462 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -73.83 151.83 40.42 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.93 -1.106 . . . . 1.5 109.622 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.671 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.52 158.16 18.65 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 106.811 -1.552 . . . . 0.47 106.811 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.671 ' H ' HD23 ' A' ' 22' ' ' LEU . 57.8 t -145.62 123.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.987 -1.07 . . . . 0.17 108.743 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -112.2 140.25 32.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 108.483 -0.932 . . . . 0.14 108.483 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.7 t -123.44 119.99 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.358 -0.838 . . . . 0.13 109.499 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -97.42 119.75 36.54 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.306 -0.871 . . . . 1.05 110.038 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -96.52 25.26 5.21 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.955 -1.091 . . . . 0.73 110.175 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.524 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.4 m -59.89 147.33 38.91 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 120.954 -1.091 . . . . 0.3 110.773 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.577 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.48 126.53 32.87 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.772 -1.196 . . . . 0.22 107.772 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.5 -33.97 76.19 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.024 -1.102 . . . . 0.3 108.024 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.577 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 59.7 p-90 -71.35 -26.63 62.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.447 -0.783 . . . . 0.26 110.686 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.6 t -80.7 112.9 18.51 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.834 -1.172 . . . . 0.26 107.834 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.469 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.36 -51.22 60.09 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 111.274 -0.73 . . . . 0.23 111.274 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -49.84 -37.87 46.41 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.754 1.277 . . . . 0.31 111.318 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.524 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -75.37 -46.98 29.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.191 -0.943 . . . . 0.24 108.913 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -59.74 -30.15 68.64 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.626 -0.879 . . . . 1.59 108.626 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 12.4 tpt -59.67 -30.19 68.58 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.601 -0.687 . . . . 2.1 110.14 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.443 HD11 ' HB1' ' A' ' 92' ' ' ALA . 6.3 mt -83.58 -4.79 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.695 -0.628 . . . . 0.49 110.756 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.548 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.54 -31.94 10.21 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.803 -1.81 . . . . 0.8 113.236 -176.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -57.91 -38.96 90.35 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 CA-C-N 121.487 1.567 . . . . 0.28 111.914 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -71.79 -51.23 23.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.146 -0.971 . . . . 0.37 108.985 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.44 -48.04 82.01 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.16 -0.962 . . . . 0.16 108.613 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -68.62 -41.24 79.77 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.567 -0.708 . . . . 0.32 110.746 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 58.7 m -63.82 -37.21 86.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.997 -1.064 . . . . 0.22 109.952 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.1 mt -62.29 -27.82 69.29 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.108 -0.995 . . . . 0.22 110.649 -178.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.2 m -51.73 -38.02 53.5 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 120.873 -1.142 . . . . 0.16 109.03 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -87.02 -15.7 37.88 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.12 -0.987 . . . . 2.16 109.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -79.02 -37.94 37.82 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.625 -1.297 . . . . 1.78 107.709 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -120.32 65.93 0.83 Allowed 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 106.857 -1.534 . . . . 0.25 106.857 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.4 p -62.93 -8.11 6.51 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 108.625 -0.88 . . . . 0.22 108.625 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -91.02 4.44 52.08 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.957 -0.757 . . . . 1.13 108.957 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.503 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.0 t -124.29 147.84 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.078 -1.453 . . . . 0.24 107.078 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.17 123.5 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 120.956 -1.09 . . . . 0.15 109.248 -178.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.579 ' C ' HD12 ' A' ' 55' ' ' LEU . 52.4 m-85 -103.94 126.87 51.38 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.35 -0.844 . . . . 0.12 110.039 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.579 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.4 mp -111.98 141.76 45.23 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 121.281 -0.887 . . . . 0.22 109.518 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -111.82 132.27 54.79 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 107.313 -1.366 . . . . 1.13 107.313 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.88 135.68 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.268 -0.895 . . . . 0.15 110.486 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 45.3 t0 -98.48 120.61 39.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.444 -0.785 . . . . 1.05 109.121 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.21 -19.6 25.92 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 O-C-N 120.643 -1.286 . . . . 0.16 108.404 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.525 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.0 m-20 -93.05 -41.65 9.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.521 -0.737 . . . . 1.08 111.812 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -95.54 -16.66 22.01 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.645 -1.284 . . . . 1.07 108.659 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.71 39.06 4.05 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.777 -1.194 . . . . 0.14 107.777 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.11 -19.99 56.07 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.753 -0.592 . . . . 1.47 109.938 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.581 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -65.03 -36.55 84.74 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.073 -1.017 . . . . 1.05 108.877 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.581 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -72.73 -42.44 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 108.409 -0.96 . . . . 0.35 108.409 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.04 -40.66 82.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.608 -0.683 . . . . 0.26 110.568 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.6 p -60.23 -40.29 89.71 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.761 -1.175 . . . . 0.24 109.577 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -66.2 -39.38 89.61 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 2.06 109.175 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.419 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.52 -4.68 59.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.152 -0.968 . . . . 0.23 110.739 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 53.77 49.98 18.01 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.852 -1.155 . . . . 2.02 109.887 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.6 t -65.01 130.46 30.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 C-N-CA 118.425 -1.31 . . . . 0.16 108.375 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -103.05 -11.07 18.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.576 -0.702 . . . . 1.6 110.694 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.495 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.25 155.81 23.2 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.599 -1.313 . . . . 0.14 110.605 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.1 p -129.44 153.63 80.63 Favored Pre-proline 0 N--CA 1.501 2.1 0 N-CA-C 108.148 -1.056 . . . . 0.15 108.148 178.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -76.59 143.33 75.75 Favored 'Cis proline' 0 N--CA 1.489 1.259 0 C-N-CA 123.613 -1.411 . . . . 0.16 112.667 -2.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.3 m -127.85 135.0 49.44 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.23 -1.026 . . . . 0.13 108.23 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -113.32 131.84 55.8 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.966 -0.753 . . . . 0.2 108.966 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.419 HE22 ' HB1' ' A' ' 69' ' ' ALA . 69.6 mt-30 -120.44 141.86 49.76 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.283 -1.006 . . . . 0.29 108.283 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -108.03 134.8 50.42 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.472 0.653 . . . . 0.14 110.226 -179.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -128.64 147.11 50.71 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 109.176 -0.675 . . . . 0.15 109.176 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -149.62 125.29 10.39 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.788 -1.19 . . . . 1.68 107.788 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 59.74 30.2 19.78 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 107.787 -1.19 . . . . 1.22 107.787 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.1 14.91 81.8 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.713 -1.355 . . . . 0.23 109.713 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.428 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 4.4 mm-40 -116.89 135.64 53.56 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.546 -0.973 . . . . 2.07 110.91 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -78.98 123.88 27.72 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.695 -0.854 . . . . 1.82 108.695 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.2 m -123.8 7.61 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.472 -0.768 . . . . 0.3 111.439 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.95 156.13 17.22 Favored Glycine 0 N--CA 1.498 2.819 0 C-N-CA 118.426 -1.845 . . . . 0.17 111.513 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -164.71 149.17 9.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.872 -0.781 . . . . 1.93 109.353 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.447 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 7.0 p90 -163.86 159.44 21.09 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.635 -0.826 . . . . 0.14 109.78 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.6 p -127.37 160.65 30.76 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.595 0.712 . . . . 0.12 109.924 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.476 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.22 140.6 5.7 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.17 -1.572 . . . . 0.12 109.17 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.443 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.28 67.27 2.5 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.219 -1.165 . . . . 0.18 109.146 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.37 95.09 4.59 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.548 -0.908 . . . . 0.88 108.548 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -34.76 77.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.141 -0.975 . . . . 1.06 111.403 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.97 -28.71 70.27 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.077 -1.015 . . . . 1.61 109.412 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.84 -34.64 76.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.331 -0.856 . . . . 1.45 108.836 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.46 -38.69 81.44 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.218 -1.03 . . . . 0.19 108.218 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -63.16 -43.4 98.41 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 119.845 -0.742 . . . . 2.1 110.46 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -44.0 77.33 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 0.19 111.143 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.9 m -65.37 -39.67 92.6 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.973 -1.079 . . . . 0.2 110.706 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.01 -48.36 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.067 -1.02 . . . . 0.16 108.267 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 105' ' ' VAL . 26.0 t-20 -60.5 -34.75 74.52 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.194 -1.039 . . . . 0.95 108.194 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.9 tt0 -67.93 -39.89 83.44 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.548 -0.72 . . . . 2.21 110.63 -178.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.655 ' HB2' HD11 ' A' ' 22' ' ' LEU . 86.2 mt -100.68 0.28 38.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.226 -0.922 . . . . 0.25 111.273 -178.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.8 p . . . . . 0 N--CA 1.497 1.905 0 O-C-N 120.569 -1.332 . . . . 1.08 108.992 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 26.8 mmtp . . . . . 0 N--CA 1.495 1.788 0 N-CA-C 108.847 -0.797 . . . . 1.31 108.847 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.476 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.7 mm -126.34 139.97 50.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 109.372 -0.603 . . . . 0.15 109.372 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 5.0 m -96.45 127.98 42.96 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 106.54 -1.652 . . . . 0.19 106.54 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.3 m -78.89 144.25 35.09 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.852 -1.155 . . . . 0.2 110.554 -178.204 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.442 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.8 m95 -79.62 -14.62 58.68 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.21 109.056 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.405 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.0 m120 . . . . . 0 N--CA 1.487 1.419 0 N-CA-C 107.788 -1.19 . . . . 0.49 107.788 179.14 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 N--CA 1.497 1.9 0 N-CA-C 108.782 -0.821 . . . . 1.67 108.782 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -97.01 124.03 40.88 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.867 -0.79 . . . . 0.31 108.867 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.2 mm -102.15 115.83 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 108.17 -1.048 . . . . 0.19 108.17 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -99.68 0.14 41.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.333 -0.854 . . . . 2.25 109.619 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.2 155.15 37.21 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.146 -0.971 . . . . 0.15 110.929 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.599 ' HA ' HG22 ' A' ' 65' ' ' VAL . 4.3 ttpm? -65.26 -32.85 74.72 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.765 -1.198 . . . . 1.65 107.765 177.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.444 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 46.5 m -58.71 -46.98 86.12 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.215 -1.031 . . . . 0.23 108.215 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.24 -31.76 70.53 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.37 -0.831 . . . . 0.17 108.837 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.559 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.2 t80 -59.81 -43.71 94.37 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.14 109.15 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -64.45 -44.01 92.47 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.584 -0.847 . . . . 1.31 108.796 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.44 -41.1 98.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.565 -0.709 . . . . 1.77 110.723 179.301 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.76 -42.17 95.34 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.252 -0.905 . . . . 0.15 109.285 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.559 HD11 ' CE2' ' A' ' 11' ' ' PHE . 87.1 mt -59.85 -39.86 86.62 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.089 -1.007 . . . . 0.17 108.418 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.41 -34.67 74.81 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.592 -0.693 . . . . 1.07 110.476 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.02 80.9 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.18 110.591 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.21 -30.97 69.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.127 -0.983 . . . . 0.17 110.067 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.95 -125.7 25.42 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.171 -1.172 . . . . 0.2 110.171 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -90.7 3.49 54.1 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -1.143 . . . . 1.07 109.964 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -75.63 148.55 38.67 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 1.5 109.892 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.698 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.54 157.78 16.51 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.667 -1.234 . . . . 0.47 107.667 179.306 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.698 ' H ' HD23 ' A' ' 22' ' ' LEU . 46.9 t -147.01 118.07 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 120.903 -1.123 . . . . 0.17 108.884 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 139.48 27.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.378 -0.971 . . . . 0.14 108.378 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.5 t -123.02 122.62 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.135 -0.978 . . . . 0.13 110.081 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -98.21 119.7 37.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.441 -0.787 . . . . 1.05 109.919 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -96.38 24.46 5.79 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.068 -1.02 . . . . 0.73 109.886 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.436 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.7 m -58.64 146.94 34.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.3 110.077 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.678 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.55 122.92 30.37 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.926 -1.139 . . . . 0.22 107.926 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 t -67.28 -30.26 70.08 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 118.962 -1.095 . . . . 0.3 108.088 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.678 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 52.1 p-90 -71.45 -27.0 62.96 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.441 -0.787 . . . . 0.26 110.885 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.6 t -83.79 120.49 26.1 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.109 -1.071 . . . . 0.26 108.109 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -62.37 -52.1 51.69 Favored Glycine 0 N--CA 1.489 2.2 0 C-N-CA 119.846 -1.169 . . . . 0.23 111.042 -178.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.4 Cg_exo -52.15 -34.58 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.702 1.251 . . . . 0.31 112.59 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.436 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.96 -53.77 7.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.91 . . . . 0.24 110.276 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -60.0 -37.37 79.48 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.803 -1.185 . . . . 1.59 109.701 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.525 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.0 tmm? -58.46 -27.98 64.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.148 -0.97 . . . . 2.1 109.342 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.4 mt -87.01 -12.07 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.599 -0.688 . . . . 0.49 112.051 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 29.6 pttt -67.44 -30.53 3.03 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 120.062 -1.649 . . . . 0.8 113.511 -177.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.8 Cg_exo -49.79 -36.78 43.43 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 121.803 1.68 . . . . 0.28 112.215 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -67.79 -44.13 78.09 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.384 -1.71 . . . . 0.37 106.384 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.35 -52.45 65.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.946 . . . . 0.16 110.101 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -67.62 -40.11 84.68 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.49 -0.757 . . . . 0.32 109.928 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 70.3 m -61.17 -39.58 90.7 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.381 -0.824 . . . . 0.22 110.567 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.2 mt -62.36 -19.58 63.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.45 -0.781 . . . . 0.22 110.707 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -55.4 -37.12 67.18 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.593 -1.317 . . . . 0.16 108.471 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -82.73 -19.8 37.22 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.509 -0.744 . . . . 2.16 109.103 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -76.62 -37.36 56.5 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.91 -1.144 . . . . 1.78 107.91 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -123.69 67.12 1.02 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.136 -1.431 . . . . 0.25 107.136 177.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 80.2 p -63.44 -10.05 15.47 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.42 0.629 . . . . 0.22 109.573 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -91.02 10.43 26.69 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.215 -1.031 . . . . 1.13 108.215 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 22' ' ' LEU . 48.2 t -128.52 148.21 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 108.353 -0.98 . . . . 0.24 108.353 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.443 HG22 ' CD1' ' A' ' 55' ' ' LEU . 30.0 mm -98.79 123.95 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.129 -0.982 . . . . 0.15 109.688 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.505 ' C ' HD12 ' A' ' 55' ' ' LEU . 65.7 m-85 -108.43 123.86 49.52 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.354 -0.841 . . . . 0.12 109.246 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.505 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.9 mp -110.26 144.81 38.41 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 120.906 -1.121 . . . . 0.22 110.136 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -112.54 129.73 56.26 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 106.577 -1.638 . . . . 1.13 106.577 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.4 t -126.46 135.54 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.19 -0.944 . . . . 0.15 110.63 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.696 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.2 t0 -94.47 119.66 33.51 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.738 -0.838 . . . . 1.05 108.738 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.2 m -69.16 -18.52 22.85 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 C-N-CA 118.638 -1.225 . . . . 0.16 108.453 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.8 m-20 -93.01 -42.68 9.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.45 -0.781 . . . . 1.08 111.343 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.484 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 81.3 m-20 -93.92 -15.26 25.13 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.623 -1.298 . . . . 1.07 108.098 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.4 38.39 4.16 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 107.684 -1.228 . . . . 0.14 107.684 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.8 pt20 -59.56 -22.63 61.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 1.47 109.8 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 4.8 p-10 -66.07 -42.9 88.81 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.104 -0.997 . . . . 1.05 108.766 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.599 HG22 ' HA ' ' A' ' 8' ' ' LYS . 21.2 t -68.72 -44.01 82.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 O-C-N 121.328 -0.858 . . . . 0.35 109.88 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.81 72.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.215 -0.928 . . . . 0.26 110.324 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.8 p -61.6 -31.66 71.74 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.045 -1.034 . . . . 0.24 108.711 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -63.81 -40.16 95.97 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.445 -0.785 . . . . 2.06 109.398 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.403 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -88.69 1.39 55.19 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.461 -0.774 . . . . 0.23 110.923 -179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 54.49 50.83 15.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.991 -1.068 . . . . 2.02 109.246 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.1 t -64.35 129.16 27.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 C-N-CA 118.261 -1.376 . . . . 0.16 107.939 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -101.71 -12.71 18.16 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.65 -0.656 . . . . 1.6 109.904 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.47 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.58 156.93 21.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.98 -1.075 . . . . 0.14 110.7 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -129.38 154.62 80.71 Favored Pre-proline 0 N--CA 1.501 2.103 0 N-CA-C 108.184 -1.043 . . . . 0.15 108.184 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -75.0 142.02 73.51 Favored 'Cis proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.841 -1.316 . . . . 0.16 113.439 -1.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -126.31 132.19 51.68 Favored 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.521 -0.918 . . . . 0.13 108.521 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.598 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.5 m-85 -111.39 127.15 55.57 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.401 -0.962 . . . . 0.2 108.401 -178.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.403 HE22 ' CB ' ' A' ' 69' ' ' ALA . 76.6 mt-30 -119.5 141.48 49.15 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.149 -0.969 . . . . 0.29 108.898 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.405 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 70.8 m-85 -107.8 132.21 53.64 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.198 0.523 . . . . 0.14 110.177 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -125.63 146.3 49.77 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.553 0.692 . . . . 0.15 109.499 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -146.69 129.78 16.46 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.622 -1.251 . . . . 1.68 107.622 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 53.34 31.99 12.89 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.108 -0.995 . . . . 1.22 109.76 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.36 19.78 77.83 Favored Glycine 0 N--CA 1.491 2.321 0 O-C-N 120.954 -1.091 . . . . 0.23 110.879 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -128.77 139.79 52.03 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.311 -1.111 . . . . 2.07 110.378 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -81.3 127.83 33.16 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.196 -0.94 . . . . 1.82 109.506 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.2 m -123.94 9.74 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.608 -0.683 . . . . 0.3 110.283 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.97 151.14 9.68 Favored Glycine 0 N--CA 1.5 2.952 0 C-N-CA 118.719 -1.705 . . . . 0.17 111.713 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -166.06 148.92 7.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.621 -0.929 . . . . 1.93 109.806 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -163.72 162.93 24.25 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.598 -0.841 . . . . 0.14 108.81 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.7 p -126.74 159.92 32.34 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.351 -0.611 . . . . 0.12 109.351 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.487 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.4 143.37 6.16 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.834 -1.306 . . . . 0.12 109.834 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.42 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.58 65.12 2.34 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.15 -1.206 . . . . 0.18 110.098 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.484 ' ND2' ' OE1' ' A' ' 95' ' ' GLU . 0.7 OUTLIER -119.46 94.0 4.27 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 107.936 -1.135 . . . . 0.88 107.936 178.334 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -33.15 73.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.079 -1.013 . . . . 1.06 111.303 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.484 ' OE1' ' ND2' ' A' ' 93' ' ' ASN . 35.1 mp0 -63.41 -30.18 71.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.943 -1.098 . . . . 1.61 109.291 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -60.73 -33.68 73.27 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.167 -0.679 . . . . 1.45 109.167 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.598 HD21 ' CD1' ' A' ' 77' ' ' PHE . 35.8 mt -59.76 -38.95 83.22 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.566 -0.902 . . . . 0.19 108.566 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -62.67 -40.93 98.62 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.095 -0.642 . . . . 2.1 110.992 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.39 -44.1 72.15 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.246 -0.909 . . . . 0.19 112.027 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.55 -38.62 91.64 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.724 -1.235 . . . . 0.2 110.025 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.13 -48.91 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 108.162 -1.051 . . . . 0.16 108.162 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.449 ' O ' HG12 ' A' ' 105' ' ' VAL . 18.1 t-20 -61.0 -34.12 74.32 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.561 -0.903 . . . . 0.95 108.561 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -68.85 -39.86 79.7 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.485 -0.759 . . . . 2.21 110.186 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.566 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.4 mt -100.72 1.45 40.45 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.376 -0.828 . . . . 0.25 111.345 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.8 p . . . . . 0 N--CA 1.499 2.002 0 O-C-N 120.475 -1.391 . . . . 1.08 109.064 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.4 mmtt . . . . . 0 N--CA 1.495 1.808 0 CA-C-O 120.935 0.398 . . . . 1.31 109.953 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.487 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.1 mm -131.94 140.71 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 N-CA-C 109.716 -0.476 . . . . 0.15 109.716 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 56.4 m -98.63 131.68 44.63 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.817 -1.549 . . . . 0.19 106.817 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -81.18 144.85 31.33 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.629 -1.294 . . . . 0.2 111.372 -178.928 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.444 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.2 m95 -79.62 -13.86 59.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.21 109.106 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 107.363 -1.347 . . . . 0.49 107.363 179.404 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptp . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 108.77 -0.826 . . . . 1.67 108.77 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -93.84 121.92 35.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.14 -0.975 . . . . 0.31 109.316 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.3 mm -101.51 117.53 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.492 -0.929 . . . . 0.19 108.492 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -99.1 -1.75 38.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.377 -0.827 . . . . 2.25 109.515 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.26 155.33 36.38 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.825 -1.172 . . . . 0.15 111.542 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -63.61 -32.87 74.47 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.94 -1.133 . . . . 1.65 107.94 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 80.5 m -58.71 -45.89 88.57 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.153 -1.019 . . . . 0.23 108.316 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.86 -31.82 69.86 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.304 -0.873 . . . . 0.17 108.86 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.556 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.5 t80 -59.14 -43.94 92.04 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.007 . . . . 0.14 108.691 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -64.62 -42.67 95.34 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.623 -0.88 . . . . 1.31 108.623 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.08 -36.85 85.37 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.67 -0.644 . . . . 1.77 109.963 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.13 -42.81 79.63 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.071 -1.018 . . . . 0.15 109.339 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.556 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.6 mt -60.52 -39.36 87.56 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.124 -1.065 . . . . 0.17 108.124 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.61 -34.37 73.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.466 -0.771 . . . . 1.07 109.892 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.68 -37.8 70.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.21 -0.931 . . . . 0.18 110.3 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -32.44 73.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.254 -0.904 . . . . 0.17 109.309 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.63 -124.76 21.95 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.983 -1.247 . . . . 0.2 109.983 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -91.41 4.74 51.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.397 -1.061 . . . . 1.07 110.271 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -76.54 149.3 36.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.154 -0.966 . . . . 1.5 109.096 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.644 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.86 156.68 16.76 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.503 -1.295 . . . . 0.47 107.503 179.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.644 ' H ' HD23 ' A' ' 22' ' ' LEU . 97.8 t -143.09 113.15 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.932 -1.105 . . . . 0.17 108.676 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.1 t -100.02 139.79 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.443 -0.947 . . . . 0.14 108.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.2 t -124.03 122.09 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.416 -0.803 . . . . 0.13 110.832 -178.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.528 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.7 t70 -98.44 120.24 38.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.631 -0.668 . . . . 1.05 110.305 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.53 25.74 4.89 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.96 -1.088 . . . . 0.73 109.756 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.535 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 57.0 m -59.43 143.25 50.35 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 120.878 -1.139 . . . . 0.3 110.453 -178.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.14 127.96 33.66 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 106.979 -1.489 . . . . 0.22 106.979 178.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -67.35 -32.25 73.06 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 118.894 -1.122 . . . . 0.3 108.318 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.623 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 61.3 p-90 -73.06 -19.8 61.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.023 -1.048 . . . . 0.26 110.657 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.2 t -85.24 116.73 23.76 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.736 -1.228 . . . . 0.26 107.867 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.451 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.57 -51.78 55.4 Favored Glycine 0 N--CA 1.496 2.662 0 O-C-N 121.659 -0.65 . . . . 0.23 111.978 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.1 Cg_exo -52.83 -36.09 72.56 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 CA-C-N 118.464 1.132 . . . . 0.31 111.907 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.535 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -76.52 -52.57 9.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.516 -0.74 . . . . 0.24 110.301 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -59.94 -36.59 77.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.129 -0.982 . . . . 1.59 109.332 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.506 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.9 tmm? -59.9 -29.3 68.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.501 -0.749 . . . . 2.1 109.549 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.604 HG22 ' O ' ' A' ' 38' ' ' ILE . 78.5 mt -79.44 -2.26 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.913 -0.492 . . . . 0.49 110.488 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.39 6.25 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 120.591 -1.318 . . . . 0.8 114.049 -177.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -57.24 -39.8 87.37 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 CA-C-N 121.842 1.693 . . . . 0.28 113.022 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -69.56 -48.52 60.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.262 -1.524 . . . . 0.37 108.651 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.06 -51.77 68.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.351 -0.843 . . . . 0.16 109.745 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -67.35 -40.94 85.87 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.589 -0.694 . . . . 0.32 110.385 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.449 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -61.31 -38.64 87.58 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.695 -1.253 . . . . 0.22 110.737 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.72 -21.52 66.44 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.22 110.701 -178.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -55.67 -35.62 66.2 Favored 'General case' 0 C--N 1.296 -1.721 0 O-C-N 120.894 -1.129 . . . . 0.16 108.277 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -85.97 -19.54 30.27 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.893 . . . . 2.16 109.897 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.24 -37.65 57.38 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 107.468 -1.308 . . . . 1.78 107.468 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.15 67.58 0.99 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.078 -1.453 . . . . 0.25 107.078 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.79 -8.27 10.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.037 -0.727 . . . . 0.22 109.037 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -90.67 10.2 26.73 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.115 -1.068 . . . . 1.13 108.115 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.5 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.5 t -129.56 142.08 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 107.696 -1.224 . . . . 0.24 107.696 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.457 HG22 ' CD1' ' A' ' 55' ' ' LEU . 26.8 mm -97.92 121.87 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.092 -1.005 . . . . 0.15 109.588 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.451 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.5 m-85 -101.62 124.15 46.8 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.364 -0.835 . . . . 0.12 109.159 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 2.3 mp -109.81 146.17 35.49 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.759 -1.213 . . . . 0.22 109.382 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.8 129.21 56.51 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 106.98 -1.489 . . . . 1.13 106.98 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.0 t -124.91 132.32 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.503 0.668 . . . . 0.15 110.377 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 54.6 t0 -95.68 118.7 32.84 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.531 -0.914 . . . . 1.05 108.531 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -65.59 -18.76 24.47 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 O-C-N 120.121 -1.612 . . . . 0.16 107.862 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.504 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.45 -40.85 10.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.631 . . . . 1.08 112.23 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.428 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 46.1 m-20 -95.61 -20.89 18.6 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.249 -1.532 . . . . 1.07 108.632 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.69 41.02 3.38 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.732 -1.21 . . . . 0.14 107.732 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -60.03 -20.66 59.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.579 -0.701 . . . . 1.47 110.097 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.721 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -62.77 -38.03 89.0 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 120.874 -1.141 . . . . 1.05 109.445 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.721 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.3 t -75.18 -44.46 43.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.013 -1.054 . . . . 0.35 109.825 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.34 -39.1 78.35 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.552 -0.859 . . . . 0.26 110.206 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -60.79 -36.48 79.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.007 -1.058 . . . . 0.24 108.539 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -63.09 -39.02 93.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 2.06 109.408 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.39 -0.06 55.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.23 110.697 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 53.09 50.2 18.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.966 -1.084 . . . . 2.02 109.728 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -66.55 132.38 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.859 -1.151 . . . . 0.16 109.35 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -103.19 -8.37 20.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.578 -0.701 . . . . 1.6 110.767 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.497 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.62 156.16 17.95 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.573 -1.33 . . . . 0.14 111.191 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.43 153.76 80.64 Favored Pre-proline 0 N--CA 1.502 2.148 0 N-CA-C 107.274 -1.38 . . . . 0.15 107.274 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -75.81 143.74 77.85 Favored 'Cis proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.848 -1.313 . . . . 0.16 112.788 -2.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.45 ' CG2' ' OE2' ' A' ' 88' ' ' GLU . 98.3 m -129.13 134.31 48.0 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.808 0.813 . . . . 0.13 108.953 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.77 ' CD1' HD21 ' A' ' 97' ' ' LEU . 93.4 m-85 -110.44 129.43 55.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 109.329 -0.619 . . . . 0.2 109.329 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -122.53 141.24 51.88 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.451 -0.944 . . . . 0.29 108.451 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -108.27 132.07 54.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.673 -0.642 . . . . 0.14 110.399 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -125.41 145.67 49.95 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.337 -0.616 . . . . 0.15 109.337 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -145.92 127.47 15.1 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.305 -1.368 . . . . 1.68 107.305 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 58.35 23.19 10.23 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.121 -1.066 . . . . 1.22 108.121 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 82.02 15.88 73.74 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 110.105 -1.198 . . . . 0.23 110.105 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.429 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.5 mm-40 -116.2 138.01 51.64 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.519 -0.989 . . . . 2.07 109.891 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -81.28 121.5 26.25 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.012 -1.107 . . . . 1.82 108.012 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.2 m -121.28 13.3 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.572 -0.705 . . . . 0.3 110.254 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -180.0 156.93 19.2 Favored Glycine 0 N--CA 1.496 2.637 0 C-N-CA 118.897 -1.621 . . . . 0.17 111.071 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.471 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 2.2 tp10 -166.84 147.73 5.91 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.65 -0.912 . . . . 1.93 108.727 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.456 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 11.0 p90 -166.98 162.58 15.69 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.199 -1.0 . . . . 0.14 108.945 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -128.88 169.61 14.4 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.621 0.724 . . . . 0.12 109.821 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.474 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 113.39 141.96 8.12 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.198 -1.561 . . . . 0.12 109.198 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.547 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -80.01 66.46 5.5 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.35 -1.088 . . . . 0.18 109.779 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -119.05 100.06 7.11 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.853 -1.166 . . . . 0.88 107.853 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.99 -33.37 73.57 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.352 -0.842 . . . . 1.06 111.924 -178.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -64.6 -29.49 70.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.802 -1.186 . . . . 1.61 110.051 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.413 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 55.2 tttp -61.9 -34.87 76.84 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.699 -0.852 . . . . 1.45 108.699 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.77 HD21 ' CD1' ' A' ' 77' ' ' PHE . 43.4 mt -59.48 -40.02 85.63 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 122.279 1.038 . . . . 0.19 108.484 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -62.61 -42.51 99.62 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.545 -0.752 . . . . 2.1 110.981 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.75 77.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.101 -0.999 . . . . 0.19 111.288 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -64.76 -39.59 93.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.773 -1.205 . . . . 0.2 110.129 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' VAL . 65.4 mt -61.55 -49.41 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.16 108.509 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.472 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.6 t-20 -60.26 -35.55 75.77 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.046 0.927 . . . . 0.95 108.613 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -67.32 -40.13 85.92 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.66 -0.65 . . . . 2.21 109.654 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.599 ' HB2' HD11 ' A' ' 22' ' ' LEU . 95.2 mt -98.74 -3.94 34.61 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.545 -0.722 . . . . 0.25 111.458 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.0 p . . . . . 0 N--CA 1.497 1.897 0 O-C-N 120.392 -1.443 . . . . 1.08 108.807 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 29.8 mmtp . . . . . 0 N--CA 1.492 1.638 0 N-CA-C 109.711 -0.477 . . . . 1.31 109.711 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.474 HD11 ' HA2' ' A' ' 91' ' ' GLY . 30.4 mm -128.8 140.42 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.914 -0.491 . . . . 0.15 110.304 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -95.66 129.76 42.76 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.224 -1.399 . . . . 0.19 107.224 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.6 m -78.52 140.58 38.54 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.757 -1.214 . . . . 0.2 111.049 -178.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.497 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.0 m95 -76.12 -8.44 57.01 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.699 -1.25 . . . . 0.21 108.975 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 m120 . . . . . 0 C--N 1.3 -1.564 0 O-C-N 121.124 -0.985 . . . . 0.49 108.739 -179.926 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.2 tptt . . . . . 0 N--CA 1.499 1.989 0 N-CA-C 108.848 -0.797 . . . . 1.67 108.848 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -97.79 124.11 42.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.383 -0.823 . . . . 0.31 109.288 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.28 115.85 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.349 -0.845 . . . . 0.19 108.788 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -99.67 -0.89 39.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.265 -0.897 . . . . 2.25 108.978 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -151.68 153.88 35.25 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.046 . . . . 0.15 111.04 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -64.3 -31.55 72.8 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.254 -1.017 . . . . 1.65 108.254 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.5 m -58.15 -47.21 84.07 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.382 -0.927 . . . . 0.23 108.601 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.12 -30.9 70.15 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.515 -0.74 . . . . 0.17 109.107 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.49 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.8 t80 -59.35 -44.05 92.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.252 -0.905 . . . . 0.14 108.977 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -65.41 -41.85 93.17 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.404 -0.961 . . . . 1.31 108.404 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.37 -37.49 87.7 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.664 -0.648 . . . . 1.77 110.299 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.12 79.14 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.277 -0.89 . . . . 0.15 109.586 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.49 HD11 ' CE2' ' A' ' 11' ' ' PHE . 88.3 mt -60.15 -40.63 90.52 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.166 -0.959 . . . . 0.17 108.537 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -68.48 -37.08 79.82 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.654 -0.653 . . . . 1.07 110.243 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.06 -36.65 80.21 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.44 -0.787 . . . . 0.18 110.406 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.31 -33.11 74.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.041 -1.037 . . . . 0.17 109.294 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.19 20.18 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.268 -1.133 . . . . 0.2 110.268 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.462 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 71.0 m-20 -89.92 0.53 57.02 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.263 -1.139 . . . . 1.07 110.457 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -73.98 147.59 42.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.825 -1.172 . . . . 1.5 109.401 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.692 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.21 159.73 7.25 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.118 -1.438 . . . . 0.47 107.118 179.79 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.685 ' H ' HD23 ' A' ' 22' ' ' LEU . 96.0 t -146.41 121.27 2.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 O-C-N 120.812 -1.18 . . . . 0.17 108.605 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.4 HG22 ' CE2' ' A' ' 79' ' ' PHE . 23.6 t -109.59 140.0 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.305 -0.998 . . . . 0.14 108.305 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.59 121.27 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.329 -0.857 . . . . 0.13 109.557 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.2 t70 -98.41 117.61 33.21 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.457 -0.777 . . . . 1.05 109.756 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -94.48 25.72 3.78 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.142 -0.974 . . . . 0.73 110.02 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.414 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 53.2 m -59.31 146.62 38.92 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 121.102 -0.999 . . . . 0.3 110.616 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.531 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.42 126.82 32.64 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.785 -1.191 . . . . 0.22 107.785 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.13 -31.61 71.31 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.938 -1.105 . . . . 0.3 108.909 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.531 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 56.1 p-90 -74.1 -22.4 59.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.427 -0.795 . . . . 0.26 111.04 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -83.39 110.44 18.15 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.74 -1.207 . . . . 0.26 107.74 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.474 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.86 -50.35 68.49 Favored Glycine 0 N--CA 1.485 1.907 0 C-N-CA 120.258 -0.972 . . . . 0.23 110.772 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.5 Cg_exo -52.48 -34.86 63.79 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 CA-C-N 118.88 1.34 . . . . 0.31 111.804 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.01 -50.73 11.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.24 110.247 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -60.19 -35.27 75.02 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.05 -1.031 . . . . 1.59 109.37 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.3 ttt -58.68 -27.32 64.71 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.391 -0.818 . . . . 2.1 109.571 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.571 HG22 ' O ' ' A' ' 38' ' ' ILE . 70.0 mt -85.02 -3.77 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.694 -0.629 . . . . 0.49 110.882 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.547 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.5 ptmt -66.94 -27.05 1.6 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 120.278 -1.514 . . . . 0.8 113.315 -177.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.9 Cg_exo -56.38 -39.33 91.98 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 CA-C-N 122.349 1.875 . . . . 0.28 112.117 -177.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -68.17 -46.06 71.77 Favored 'General case' 0 C--N 1.301 -1.506 0 C-N-CA 118.181 -1.408 . . . . 0.37 108.458 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -60.11 -52.1 66.79 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.914 0.864 . . . . 0.16 109.406 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -67.27 -45.57 76.24 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.7 -0.625 . . . . 0.32 110.244 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.3 m -60.2 -38.4 83.2 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.263 -0.898 . . . . 0.22 110.601 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 mt -63.08 -24.48 67.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.086 -1.009 . . . . 0.22 110.753 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.4 m -53.4 -36.24 61.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.872 -1.142 . . . . 0.16 108.745 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 mp0 -85.3 -15.98 41.57 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.035 -1.041 . . . . 2.16 108.627 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.0 -37.61 38.77 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.393 -1.336 . . . . 1.78 107.393 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -123.69 69.05 1.03 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.338 -1.356 . . . . 0.25 107.338 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -65.66 -13.45 59.21 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 108.35 -0.981 . . . . 0.22 108.35 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -82.23 -3.74 55.69 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.321 -0.992 . . . . 1.13 108.321 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.476 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.0 t -118.43 141.75 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 N-CA-C 107.463 -1.31 . . . . 0.24 107.463 178.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -97.96 122.38 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.172 -0.955 . . . . 0.15 109.822 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.657 ' C ' HD12 ' A' ' 55' ' ' LEU . 39.1 m-85 -101.06 131.51 46.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.311 -0.868 . . . . 0.12 110.419 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.657 HD12 ' C ' ' A' ' 54' ' ' PHE . 6.4 mp -116.33 140.96 48.78 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.288 -0.883 . . . . 0.22 109.243 178.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -110.21 130.01 55.62 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.843 -1.54 . . . . 1.13 106.843 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.99 135.11 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.253 -0.904 . . . . 0.15 110.663 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.507 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 54.3 t0 -97.03 119.76 36.12 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.76 -0.83 . . . . 1.05 108.76 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 28.1 m -68.85 -17.63 22.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.786 -1.197 . . . . 0.16 108.213 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.529 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.5 m-20 -94.24 -41.02 9.69 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.403 -0.81 . . . . 1.08 112.041 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.451 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 41.0 m-20 -96.86 -16.56 20.69 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.598 -1.314 . . . . 1.07 108.293 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.09 39.89 3.86 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.03 -1.1 . . . . 0.14 108.03 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -60.08 -24.56 64.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.676 -0.64 . . . . 1.47 110.224 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.545 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.4 p30 -63.71 -37.33 86.94 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.812 -1.18 . . . . 1.05 108.739 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.545 HG23 ' OD1' ' A' ' 64' ' ' ASP . 8.1 t -70.34 -44.04 77.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.271 -0.893 . . . . 0.35 109.587 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.52 67.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.516 -0.74 . . . . 0.26 111.178 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -60.26 -35.72 76.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.948 -1.095 . . . . 0.24 109.541 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -63.65 -36.9 85.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.292 -0.88 . . . . 2.06 109.181 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.417 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -88.44 -2.21 58.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.23 -0.919 . . . . 0.23 110.884 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 55.44 49.04 17.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.04 -1.038 . . . . 2.02 109.847 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.4 t -64.05 133.02 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 C-N-CA 118.574 -1.25 . . . . 0.16 108.442 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -104.86 -12.36 16.29 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.639 -0.663 . . . . 1.6 109.936 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.55 155.99 20.34 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.849 -1.157 . . . . 0.14 111.207 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.405 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.5 p -129.31 155.51 79.89 Favored Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 107.859 -1.163 . . . . 0.15 107.859 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -76.05 141.77 71.56 Favored 'Cis proline' 0 N--CA 1.493 1.469 0 C-N-CA 123.749 -1.355 . . . . 0.16 112.675 -1.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -127.38 137.3 52.72 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.597 -0.89 . . . . 0.13 108.597 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.789 ' CD1' HD21 ' A' ' 97' ' ' LEU . 90.9 m-85 -113.74 130.04 56.49 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 108.612 -0.884 . . . . 0.2 108.612 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.454 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 80.9 mt-30 -120.57 140.02 52.11 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.269 -0.894 . . . . 0.29 108.673 179.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.436 ' CE1' HG21 ' A' ' 100' ' ' THR . 86.5 m-85 -107.48 133.01 52.6 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.436 0.636 . . . . 0.14 110.318 -179.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -128.61 145.92 51.0 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 108.996 -0.742 . . . . 0.15 108.996 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -147.81 131.24 16.66 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.16 -1.422 . . . . 1.68 107.16 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.462 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 68.6 mttm 56.01 27.93 12.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.279 -0.888 . . . . 1.22 109.549 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.86 15.29 79.5 Favored Glycine 0 N--CA 1.493 2.485 0 C-N-CA 120.061 -1.066 . . . . 0.23 110.902 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -125.06 141.54 52.06 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.088 -1.243 . . . . 2.07 110.508 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.454 ' NZ ' ' OE1' ' A' ' 78' ' ' GLN . 20.3 ttmm -78.56 126.98 31.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.274 -0.892 . . . . 1.82 109.392 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.89 11.75 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.728 -0.608 . . . . 0.3 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.93 154.14 14.52 Favored Glycine 0 N--CA 1.494 2.552 0 C-N-CA 118.388 -1.863 . . . . 0.17 111.743 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 3.2 tp10 -165.14 136.49 4.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.997 -0.708 . . . . 1.93 109.642 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.543 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.9 p90 -163.26 158.5 21.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.328 -0.857 . . . . 0.14 109.947 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -127.97 160.18 32.7 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.61 0.719 . . . . 0.12 110.37 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 126.56 141.88 5.55 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.394 -1.482 . . . . 0.12 109.394 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.451 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.2 65.17 2.12 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.339 -1.095 . . . . 0.18 109.626 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.0 97.78 5.77 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.353 -0.842 . . . . 0.88 108.77 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -33.28 73.31 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.017 -1.052 . . . . 1.06 111.174 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.18 -30.08 70.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.953 -1.092 . . . . 1.61 109.68 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.54 -34.72 74.55 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.566 -0.709 . . . . 1.45 109.337 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.789 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.4 mt -59.44 -40.07 85.59 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.551 -0.907 . . . . 0.19 108.551 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.95 -43.92 97.48 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 119.402 -0.919 . . . . 2.1 110.347 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.62 -44.81 77.1 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.136 -1.026 . . . . 0.19 110.624 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.436 HG21 ' CE1' ' A' ' 79' ' ' PHE . 22.0 m -64.3 -40.06 95.18 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.793 -1.192 . . . . 0.2 108.478 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.95 -46.64 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 107.503 -1.295 . . . . 0.16 107.503 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.473 ' O ' HG12 ' A' ' 105' ' ' VAL . 0.9 OUTLIER -60.12 -35.94 76.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.05 -1.093 . . . . 0.95 108.05 179.216 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -68.73 -40.1 80.05 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.626 -0.671 . . . . 2.21 110.164 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.692 ' HB2' HD11 ' A' ' 22' ' ' LEU . 87.6 mt -98.26 -2.73 38.9 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.143 -0.973 . . . . 0.25 111.63 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.2 p . . . . . 0 N--CA 1.499 1.999 0 O-C-N 120.504 -1.372 . . . . 1.08 109.551 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.2 mmtt . . . . . 0 N--CA 1.489 1.496 0 N-CA-C 109.706 -0.479 . . . . 1.31 109.706 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.445 HD11 ' HA2' ' A' ' 91' ' ' GLY . 36.3 mm -130.04 141.44 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.812 -0.555 . . . . 0.15 109.754 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 24.2 m -99.9 131.51 45.83 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 106.934 -1.506 . . . . 0.19 106.934 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -84.06 142.69 30.24 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.661 -1.275 . . . . 0.2 111.441 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.448 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.4 m95 -75.44 -11.14 59.98 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.216 -0.927 . . . . 0.21 108.995 178.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.43 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.0 m120 . . . . . 0 N--CA 1.49 1.526 0 N-CA-C 108.513 -0.921 . . . . 0.49 108.513 179.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? . . . . . 0 N--CA 1.49 1.562 0 N-CA-C 108.707 -0.849 . . . . 1.67 108.707 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -98.18 124.07 42.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.633 -0.877 . . . . 0.31 108.633 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.0 mm -101.16 112.66 34.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.956 -0.757 . . . . 0.19 108.956 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.468 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.0 mp0 -95.53 -0.2 52.36 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.195 -0.94 . . . . 2.25 109.464 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -156.04 159.33 39.04 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.909 -1.119 . . . . 0.15 111.166 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -65.41 -31.92 73.27 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.174 -1.047 . . . . 1.65 108.174 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.8 m -58.01 -49.46 76.76 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.517 -0.873 . . . . 0.23 109.067 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.26 69.24 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.323 -0.86 . . . . 0.17 109.042 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.54 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.7 t80 -58.48 -43.58 89.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.037 -1.039 . . . . 0.14 108.713 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -64.56 -43.87 92.54 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.966 -0.753 . . . . 1.31 108.966 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.59 -36.26 83.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.645 -0.66 . . . . 1.77 110.059 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.32 80.89 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.165 -0.959 . . . . 0.15 109.19 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.54 HD11 ' CE2' ' A' ' 11' ' ' PHE . 75.7 mt -61.14 -41.18 96.27 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.186 -0.946 . . . . 0.17 109.016 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -68.46 -35.26 77.32 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.628 -0.67 . . . . 1.07 110.508 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -39.58 81.18 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.271 -0.893 . . . . 0.18 110.234 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' A' ' 23' ' ' VAL . . . -60.85 -34.6 74.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.386 -0.821 . . . . 0.17 109.746 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -124.58 21.2 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.648 -1.381 . . . . 0.2 109.648 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -90.75 -1.53 57.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 120.982 -1.304 . . . . 1.07 110.51 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -75.02 149.99 39.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.934 -1.104 . . . . 1.5 108.805 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 22' ' ' LEU . 10.8 mt -58.79 160.03 6.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.09 -1.006 . . . . 0.47 110.543 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.4 ' CG2' ' CB ' ' A' ' 18' ' ' ALA . 62.9 t -148.0 111.75 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 107.974 -1.121 . . . . 0.17 107.974 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.409 HG22 ' CD2' ' A' ' 79' ' ' PHE . 59.8 t -103.66 144.19 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 107.47 -1.308 . . . . 0.14 107.47 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.9 t -125.34 122.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.192 -0.942 . . . . 0.13 110.549 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.53 117.41 33.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.377 -0.827 . . . . 1.05 109.932 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -94.12 26.45 3.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.937 . . . . 0.73 110.179 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -60.3 144.65 50.01 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.823 -1.173 . . . . 0.3 110.16 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.553 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.57 125.5 32.49 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.43 -0.952 . . . . 0.22 108.43 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.0 t -65.59 -32.71 74.44 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.105 -0.997 . . . . 0.3 108.729 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.553 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 54.7 p-90 -72.11 -23.22 61.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.196 -0.94 . . . . 0.26 111.03 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 21.5 t -81.05 123.19 28.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.768 -1.207 . . . . 0.26 108.734 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.94 -56.53 22.0 Favored Glycine 0 N--CA 1.493 2.446 0 O-C-N 121.637 -0.664 . . . . 0.23 112.159 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 8.0 Cg_endo -59.94 -29.48 89.5 Favored 'Trans proline' 0 C--N 1.314 -1.267 0 CA-C-N 119.45 1.625 . . . . 0.31 112.605 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.414 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -77.22 -54.99 5.81 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.844 -1.16 . . . . 0.24 109.918 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt -60.26 -39.32 86.36 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.085 -1.009 . . . . 1.59 109.444 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.512 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.3 tmt? -59.76 -28.92 67.8 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.653 -0.654 . . . . 2.1 109.89 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 38' ' ' ILE . 68.0 mt -80.73 -3.7 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.708 -0.62 . . . . 0.49 110.454 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.4 ptmt -65.12 -27.6 2.3 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 120.486 -1.384 . . . . 0.8 113.295 -177.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.0 Cg_exo -55.93 -39.27 92.19 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 CA-C-N 122.563 1.951 . . . . 0.28 112.888 -176.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.12 -45.01 71.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.632 -1.292 . . . . 0.37 108.842 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.38 -52.81 63.08 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.121 -0.987 . . . . 0.16 109.454 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.0 t60 -68.22 -40.29 82.12 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.774 -0.578 . . . . 0.32 110.678 179.899 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.8 m -62.61 -39.62 94.34 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.22 111.374 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -63.92 -19.43 65.1 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.912 -1.117 . . . . 0.22 110.372 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.4 m -55.16 -38.43 68.29 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 120.755 -1.216 . . . . 0.16 108.481 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -83.2 -17.59 42.24 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.031 -1.043 . . . . 2.16 109.635 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -77.93 -35.9 49.96 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.453 -1.314 . . . . 1.78 107.453 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -122.46 68.15 0.95 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.077 -1.453 . . . . 0.25 107.077 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.8 p -66.1 -9.61 32.78 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.642 -0.873 . . . . 0.22 108.642 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -88.91 6.66 38.29 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.056 -1.09 . . . . 1.13 108.056 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 78.7 t -127.05 146.41 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 107.885 -1.154 . . . . 0.24 107.885 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.409 HG22 ' CD1' ' A' ' 55' ' ' LEU . 22.8 mm -99.98 123.84 53.05 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 120.822 -1.174 . . . . 0.15 109.777 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.487 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.2 m-85 -105.72 125.59 51.16 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.273 -0.892 . . . . 0.12 109.179 179.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.487 HD12 ' C ' ' A' ' 54' ' ' PHE . 3.2 mp -110.33 141.18 43.71 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.984 -1.073 . . . . 0.22 109.566 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -110.89 131.67 54.85 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 106.517 -1.66 . . . . 1.13 106.517 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.3 t -126.49 137.52 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.404 -0.81 . . . . 0.15 110.097 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.55 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.1 t0 -99.06 119.22 37.46 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 107.821 -1.178 . . . . 1.05 107.821 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -67.99 -18.72 23.94 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 120.66 -1.275 . . . . 0.16 108.469 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.551 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -92.63 -41.19 10.33 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.548 -0.72 . . . . 1.08 111.819 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -96.48 -18.71 19.66 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.596 -1.315 . . . . 1.07 108.062 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -120.44 38.87 3.88 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.569 -1.271 . . . . 0.14 107.569 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -60.34 -23.51 64.31 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.702 -0.624 . . . . 1.47 109.947 -178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.605 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -64.82 -38.13 89.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.696 -1.253 . . . . 1.05 109.216 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.605 HG23 ' OD1' ' A' ' 64' ' ' ASP . 14.2 t -70.89 -44.16 76.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 121.786 0.803 . . . . 0.35 109.618 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.99 -39.71 72.3 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.685 -0.634 . . . . 0.26 110.5 -178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.4 p -59.97 -32.54 70.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.936 -1.102 . . . . 0.24 109.02 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -62.26 -39.04 91.59 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.438 -0.789 . . . . 2.06 108.901 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.22 0.2 57.31 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.559 -0.713 . . . . 0.23 110.923 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 53.29 49.97 18.63 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.996 -1.065 . . . . 2.02 109.684 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.18 133.13 30.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.735 -1.228 . . . . 0.16 108.684 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.2 -10.89 18.42 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.588 -0.695 . . . . 1.6 110.41 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.469 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.18 157.08 20.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.595 -1.316 . . . . 0.14 111.007 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -128.53 155.08 79.38 Favored Pre-proline 0 N--CA 1.501 2.115 0 N-CA-C 107.516 -1.29 . . . . 0.15 107.516 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -75.62 140.83 68.74 Favored 'Cis proline' 0 N--CA 1.493 1.461 0 C-N-CA 123.731 -1.362 . . . . 0.16 113.206 -3.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -126.03 137.32 53.64 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.057 -1.09 . . . . 0.13 108.057 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.434 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 90.2 m-85 -115.9 131.1 57.04 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.863 -1.162 . . . . 0.2 107.863 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -123.93 144.65 49.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.281 -0.887 . . . . 0.29 108.916 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.409 ' CD2' HG22 ' A' ' 24' ' ' VAL . 55.6 m-85 -108.23 132.51 53.58 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.639 0.733 . . . . 0.14 110.693 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -126.86 143.37 51.29 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.662 -0.866 . . . . 0.15 108.662 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -146.72 128.37 15.18 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.536 -1.283 . . . . 1.68 107.536 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.2 mttp 59.22 28.22 17.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.467 -0.938 . . . . 1.22 108.467 -178.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.11 18.96 79.06 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.742 -1.343 . . . . 0.23 109.742 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -123.71 139.9 53.52 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.389 -1.065 . . . . 2.07 110.957 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -80.03 123.32 27.73 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.846 -0.798 . . . . 1.82 108.846 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.4 m -123.15 9.37 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.513 -0.742 . . . . 0.3 111.122 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.0 160.26 27.24 Favored Glycine 0 N--CA 1.498 2.768 0 C-N-CA 118.795 -1.669 . . . . 0.17 110.948 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.499 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.5 tp10 -169.01 148.0 4.0 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.627 -0.925 . . . . 1.93 109.612 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.499 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 5.6 p90 -168.63 157.39 8.56 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.471 -0.768 . . . . 0.14 109.911 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -128.47 160.09 33.38 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.611 -0.681 . . . . 0.12 109.5 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.511 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.39 143.49 6.33 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.312 -1.515 . . . . 0.12 109.312 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.12 67.64 3.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.05 -1.265 . . . . 0.18 110.207 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.82 95.31 4.66 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.478 -0.764 . . . . 0.88 108.985 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -32.21 70.97 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.143 -0.973 . . . . 1.06 111.679 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.89 -29.7 70.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.851 -1.155 . . . . 1.61 109.572 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -60.34 -35.45 75.68 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.46 0.647 . . . . 1.45 109.327 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.0 mt -59.26 -39.85 84.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 122.083 0.945 . . . . 0.19 108.709 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -62.35 -43.68 98.25 Favored 'General case' 0 C--N 1.288 -2.093 0 C-N-CA 120.104 -0.638 . . . . 2.1 110.98 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.29 -43.15 74.42 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.073 -1.017 . . . . 0.19 111.135 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.0 m -64.96 -39.91 94.19 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.825 -1.172 . . . . 0.2 110.147 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.28 -49.25 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.16 108.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.406 ' O ' HG12 ' A' ' 105' ' ' VAL . 25.9 t-20 -60.56 -34.87 74.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.124 0.964 . . . . 0.95 108.653 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.8 tm-20 -67.86 -40.02 83.67 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.427 -0.796 . . . . 2.21 110.037 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.6 mt -100.2 -4.61 29.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.216 -0.928 . . . . 0.25 111.732 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.424 ' OXT' HG13 ' A' ' 105' ' ' VAL . 9.9 p . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.198 -1.564 . . . . 1.08 109.048 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 69.3 mmtt . . . . . 0 N--CA 1.492 1.65 0 N-CA-C 108.847 -0.797 . . . . 1.31 108.847 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.511 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.5 mm -131.6 144.8 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.628 0 O-C-N 121.894 -0.504 . . . . 0.15 109.822 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.88 132.08 50.48 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 107.522 -1.288 . . . . 0.19 107.522 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -82.56 140.74 33.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.807 -1.183 . . . . 0.2 111.054 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.469 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.7 m95 -76.97 -7.94 56.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.896 -1.128 . . . . 0.21 108.458 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m120 . . . . . 0 C--N 1.304 -1.38 0 N-CA-C 108.374 -0.972 . . . . 0.49 108.374 -179.759 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 tptt . . . . . 0 N--CA 1.497 1.875 0 N-CA-C 108.464 -0.939 . . . . 1.67 108.464 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -98.89 122.25 41.89 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.295 -0.878 . . . . 0.31 108.878 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.7 mm -100.06 114.65 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 N-CA-C 108.673 -0.862 . . . . 0.19 108.673 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -99.77 -0.08 40.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.258 -0.902 . . . . 2.25 109.547 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -154.29 156.83 37.7 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.966 -1.084 . . . . 0.15 110.982 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -64.24 -32.21 73.71 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.974 -1.121 . . . . 1.65 107.974 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -56.49 -47.49 79.14 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.539 -0.912 . . . . 0.23 108.539 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.71 -31.6 69.7 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.439 -0.788 . . . . 0.17 109.243 178.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.505 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.9 t80 -58.7 -44.66 90.41 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.005 -1.059 . . . . 0.14 109.033 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -64.52 -42.2 95.93 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 108.832 -0.803 . . . . 1.31 108.832 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.58 -36.26 83.66 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.383 0.611 . . . . 1.77 110.399 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.82 77.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.301 -0.874 . . . . 0.15 108.999 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.505 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.5 mt -60.12 -40.05 88.39 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.96 -1.126 . . . . 0.17 107.96 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -69.81 -40.14 76.1 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.55 -0.719 . . . . 1.07 110.264 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.14 -32.37 68.87 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.37 -0.831 . . . . 0.18 110.457 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.59 -26.19 68.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.048 -1.033 . . . . 0.17 108.997 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.17 -130.91 30.04 Favored Glycine 0 N--CA 1.487 2.04 0 N-CA-C 109.8 -1.32 . . . . 0.2 109.8 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.62 3.0 56.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.233 -1.157 . . . . 1.07 110.729 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -73.44 149.49 42.38 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.886 -1.134 . . . . 1.5 109.665 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.645 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -58.52 158.72 7.25 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.056 -1.461 . . . . 0.47 107.056 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.645 ' H ' HD23 ' A' ' 22' ' ' LEU . 85.3 t -143.91 109.69 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 120.93 -1.106 . . . . 0.17 108.816 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.2 t -98.64 141.27 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 108.222 -1.029 . . . . 0.14 108.222 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.9 t -124.17 122.41 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.503 -0.748 . . . . 0.13 109.518 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -99.3 116.45 31.5 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.275 -0.891 . . . . 1.05 109.633 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -92.41 20.43 6.18 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.061 -1.024 . . . . 0.73 109.875 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.29 146.09 20.13 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.735 -1.228 . . . . 0.3 110.483 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.729 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.6 122.4 30.48 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.927 -1.138 . . . . 0.22 107.927 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -63.81 -29.86 71.02 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.062 -1.055 . . . . 0.3 108.582 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.729 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 63.6 p-90 -74.88 -17.88 60.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.312 -0.867 . . . . 0.26 110.694 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -84.76 119.53 25.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.792 -1.193 . . . . 0.26 108.55 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.481 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.97 -54.14 39.33 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.894 -0.67 . . . . 0.23 112.247 -178.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.9 Cg_endo -60.18 -29.95 90.21 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 CA-C-N 119.286 1.543 . . . . 0.31 112.426 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.49 -48.01 20.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.051 . . . . 0.24 109.753 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -59.97 -32.48 70.86 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.18 -0.95 . . . . 1.59 109.09 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 15.1 tmm? -59.09 -26.95 65.09 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.34 -0.85 . . . . 2.1 110.041 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.443 HD11 ' HB1' ' A' ' 92' ' ' ALA . 6.0 mt -82.21 -5.72 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.398 -0.814 . . . . 0.49 111.223 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.02 -30.36 7.18 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 119.802 -1.811 . . . . 0.8 113.336 -178.203 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.3 Cg_exo -60.0 -42.46 44.1 Favored 'Trans proline' 0 C--O 1.204 -1.189 0 CA-C-N 121.518 1.578 . . . . 0.28 112.027 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.22 -48.81 60.93 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 118.525 -1.27 . . . . 0.37 109.362 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.16 -52.82 63.7 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.806 0.812 . . . . 0.16 109.775 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -67.87 -40.32 83.61 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.797 -0.564 . . . . 0.32 111.033 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.6 m -64.2 -38.2 90.19 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.77 -1.206 . . . . 0.22 110.777 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.14 -20.5 65.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.141 -0.974 . . . . 0.22 111.142 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -52.95 -40.53 63.74 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 120.824 -1.173 . . . . 0.16 109.075 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -84.92 -16.64 40.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.115 -0.991 . . . . 2.16 109.432 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -76.21 -37.95 57.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.24 -1.393 . . . . 1.78 107.24 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.43 ' C ' ' H ' ' A' ' 51' ' ' ASN . 84.3 m-85 -123.63 68.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.282 -1.377 . . . . 0.25 107.282 177.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.3 p -62.81 -5.12 2.52 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.104 -1.073 . . . . 0.22 108.104 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.9 t-20 -80.48 -20.2 44.23 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.921 -0.77 . . . . 1.13 108.921 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 22' ' ' LEU . 62.4 t -109.55 147.61 13.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 N-CA-C 108.465 -0.939 . . . . 0.24 108.465 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -99.77 118.36 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 108.695 -0.854 . . . . 0.15 108.695 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.562 ' C ' HD12 ' A' ' 55' ' ' LEU . 21.1 m-85 -97.43 124.99 41.81 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.021 -1.05 . . . . 0.12 109.798 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.562 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.5 mp -110.07 141.75 42.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.264 -0.898 . . . . 0.22 108.969 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -109.79 130.17 55.55 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.881 -1.526 . . . . 1.13 106.881 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.7 t -125.76 135.48 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.384 -0.822 . . . . 0.15 110.414 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.483 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.4 t0 -97.38 118.87 34.83 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.474 -0.766 . . . . 1.05 109.145 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.9 m -66.12 -20.46 27.3 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 120.584 -1.322 . . . . 0.16 108.392 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.521 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 19.0 m-20 -91.41 -44.05 9.37 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.551 -0.718 . . . . 1.08 112.077 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.434 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 70.4 m-20 -95.21 -14.46 24.05 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.582 -1.324 . . . . 1.07 108.892 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.92 37.82 4.32 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.349 -1.352 . . . . 0.14 107.349 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -59.93 -21.17 60.79 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 121.128 0.49 . . . . 1.47 110.116 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.593 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -65.5 -39.15 91.54 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.906 -1.121 . . . . 1.05 108.482 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.593 HG23 ' OD1' ' A' ' 64' ' ' ASP . 15.4 t -70.95 -45.67 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.434 -0.791 . . . . 0.35 109.527 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -37.42 75.84 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.545 -0.722 . . . . 0.26 110.884 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.2 p -60.56 -38.0 83.11 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.978 -1.077 . . . . 0.24 109.845 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.1 -38.89 92.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.192 -0.942 . . . . 2.06 109.88 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -83.46 -2.97 57.11 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 0.23 109.909 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 55.08 49.84 16.63 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.357 -0.84 . . . . 2.02 109.479 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.39 130.16 27.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.708 -1.197 . . . . 0.16 108.568 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -102.28 -10.98 19.06 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.701 -0.624 . . . . 1.6 110.57 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.482 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.87 155.77 16.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.687 -1.258 . . . . 0.14 110.962 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -129.67 155.32 80.52 Favored Pre-proline 0 N--CA 1.504 2.238 0 N-CA-C 108.563 -0.902 . . . . 0.15 108.563 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -75.38 142.16 73.5 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.882 -1.299 . . . . 0.16 113.073 -2.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.482 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 87.2 m -127.3 136.23 51.65 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 108.553 -0.906 . . . . 0.13 108.553 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.626 ' CD1' HD21 ' A' ' 97' ' ' LEU . 92.7 m-85 -114.09 130.14 56.59 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 108.674 -0.861 . . . . 0.2 108.674 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -121.97 140.85 51.95 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.704 -0.85 . . . . 0.29 108.704 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -107.75 132.16 53.68 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.544 0.688 . . . . 0.14 110.887 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -127.21 149.37 50.02 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.472 0.653 . . . . 0.15 109.476 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -149.55 125.13 10.35 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.623 -1.251 . . . . 1.68 107.623 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.2 mttt 58.82 28.41 17.39 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.811 -1.181 . . . . 1.22 107.811 -178.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.421 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 77.55 13.51 83.43 Favored Glycine 0 N--CA 1.487 2.073 0 N-CA-C 110.049 -1.22 . . . . 0.23 110.049 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.421 HE21 ' C ' ' A' ' 83' ' ' GLY . 6.7 mm-40 -114.78 134.69 54.91 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.269 -1.136 . . . . 2.07 110.409 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -81.32 121.91 26.79 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.55 -0.907 . . . . 1.82 108.55 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.2 m -125.16 16.33 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.628 -0.67 . . . . 0.3 110.607 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.43 155.47 15.15 Favored Glycine 0 N--CA 1.495 2.624 0 C-N-CA 118.924 -1.607 . . . . 0.17 110.994 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.484 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.3 tp10 -168.0 149.32 5.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.619 -0.882 . . . . 1.93 108.619 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.484 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.0 p90 -168.5 158.86 9.85 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.134 -0.979 . . . . 0.14 109.434 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -127.19 162.33 26.41 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.388 -0.82 . . . . 0.12 110.335 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.487 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.44 142.77 6.46 Favored Glycine 0 N--CA 1.503 3.119 0 N-CA-C 109.985 -1.246 . . . . 0.12 109.985 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.443 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -77.27 64.53 2.69 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.028 -1.278 . . . . 0.18 110.208 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.61 97.82 5.93 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.264 -1.013 . . . . 0.88 108.264 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -32.63 71.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.185 -0.947 . . . . 1.06 111.461 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.46 -30.82 71.88 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.975 -1.078 . . . . 1.61 109.371 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.94 -34.7 75.13 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.323 0.582 . . . . 1.45 109.58 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.626 HD21 ' CD1' ' A' ' 77' ' ' PHE . 58.9 mt -59.53 -37.81 79.34 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.039 0.923 . . . . 0.19 108.574 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -64.09 -42.04 97.07 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 120.3 -0.56 . . . . 2.1 111.425 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -43.94 77.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.961 -1.087 . . . . 0.19 111.565 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -65.75 -38.91 90.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.834 -1.166 . . . . 0.2 109.72 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.93 -49.97 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.041 -1.037 . . . . 0.16 108.405 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.454 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.3 t-20 -60.14 -34.9 74.18 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-O 122.091 0.948 . . . . 0.95 108.458 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -67.91 -39.88 83.51 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.574 -0.703 . . . . 2.21 109.938 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.618 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.8 mt -99.52 -1.69 37.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.202 -0.936 . . . . 0.25 111.414 -179.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.475 HG13 ' O ' ' A' ' 105' ' ' VAL . 9.2 p . . . . . 0 N--CA 1.496 1.872 0 O-C-N 120.297 -1.502 . . . . 1.08 109.1 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 109.839 -0.43 . . . . 1.31 109.839 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.487 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.4 mm -128.88 139.86 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 109.462 -0.57 . . . . 0.15 109.462 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.8 m -100.22 127.77 46.43 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -79.47 142.37 35.91 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.811 -1.181 . . . . 0.2 111.161 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.435 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.3 m95 -78.09 -12.19 59.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.254 -0.904 . . . . 0.21 109.435 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.491 1.586 0 N-CA-C 108.263 -1.014 . . . . 0.49 108.263 179.624 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptm . . . . . 0 N--CA 1.5 2.041 0 N-CA-C 108.214 -1.032 . . . . 1.67 108.214 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -97.07 125.23 41.39 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.202 -0.937 . . . . 0.31 109.341 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 mm -103.64 115.76 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 108.663 -0.866 . . . . 0.19 108.663 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -99.32 -0.16 41.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.137 -0.977 . . . . 2.25 109.778 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.87 155.58 37.34 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.726 -1.234 . . . . 0.15 111.068 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -65.0 -31.5 72.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.461 -0.94 . . . . 1.65 108.461 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.5 m -58.65 -47.99 82.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 0.23 109.157 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.74 66.11 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.277 -0.889 . . . . 0.17 109.143 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.504 ' CE2' HD11 ' A' ' 15' ' ' LEU . 50.4 t80 -60.05 -44.37 94.74 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.098 -1.001 . . . . 0.14 108.741 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -64.75 -43.04 94.6 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.855 -0.795 . . . . 1.31 108.855 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.01 -36.49 84.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.203 0.525 . . . . 1.77 110.487 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.08 -42.05 80.96 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.266 -0.896 . . . . 0.15 109.221 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.504 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.6 mt -60.26 -40.1 89.16 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.602 -0.888 . . . . 0.17 108.602 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -67.98 -36.78 80.6 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.485 0.66 . . . . 1.07 110.337 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.71 -39.2 84.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.485 -0.759 . . . . 0.18 110.56 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.89 -32.16 71.62 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.234 -0.916 . . . . 0.17 109.45 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.09 -124.91 17.83 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.809 -1.316 . . . . 0.2 109.809 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -91.77 4.02 53.77 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.109 -1.23 . . . . 1.07 110.367 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -76.2 147.89 38.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.047 -1.033 . . . . 1.5 109.482 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.646 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.25 158.69 8.7 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.249 -1.389 . . . . 0.47 107.249 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.644 ' H ' HD23 ' A' ' 22' ' ' LEU . 88.3 t -146.07 113.09 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.633 -1.292 . . . . 0.17 108.873 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 79' ' ' PHE . 41.1 t -99.69 141.33 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 108.401 -0.962 . . . . 0.14 108.401 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.8 t -124.1 123.72 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.196 -0.94 . . . . 0.13 109.681 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.8 t70 -100.98 116.66 33.34 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.407 -0.808 . . . . 1.05 110.687 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -94.41 24.2 4.68 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.23 -0.919 . . . . 0.73 110.991 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -59.56 149.28 30.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 120.756 -1.215 . . . . 0.3 110.647 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.746 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.06 124.8 32.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.175 -1.417 . . . . 0.22 107.175 178.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.35 -30.38 70.76 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 118.896 -1.121 . . . . 0.3 108.042 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.746 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.0 p-90 -75.7 -13.85 60.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.423 -0.798 . . . . 0.26 110.741 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.429 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 23.3 t -85.78 118.3 25.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.745 -1.222 . . . . 0.26 108.225 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.42 -54.08 38.98 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 120.73 -0.748 . . . . 0.23 112.265 -177.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.7 Cg_endo -60.44 -29.86 89.6 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 CA-C-N 119.539 1.669 . . . . 0.31 112.183 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -76.2 -47.77 22.87 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.015 -1.053 . . . . 0.24 109.726 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -60.05 -32.11 70.61 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.252 -0.905 . . . . 1.59 109.787 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.409 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 44.6 ttm -59.93 -29.3 68.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.506 -0.746 . . . . 2.1 110.12 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -79.76 -4.52 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.701 -0.624 . . . . 0.49 111.026 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.532 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.53 -31.24 8.53 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 120.188 -1.57 . . . . 0.8 113.712 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.1 Cg_exo -59.63 -38.85 79.19 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 CA-C-N 121.756 1.663 . . . . 0.28 112.159 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -71.23 -50.69 30.36 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 118.763 -1.175 . . . . 0.37 108.894 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -59.97 -47.35 86.18 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.099 -1.001 . . . . 0.16 109.178 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -68.91 -42.37 76.97 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.588 -0.695 . . . . 0.32 111.282 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 66.3 m -65.91 -39.15 90.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.905 -1.122 . . . . 0.22 110.622 -179.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.93 -22.46 62.47 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.201 -0.937 . . . . 0.22 110.308 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -56.76 -35.27 68.44 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.855 -1.153 . . . . 0.16 108.835 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -89.48 -12.62 39.57 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.957 -1.089 . . . . 2.16 109.503 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 ttmm -81.84 -36.08 28.68 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.182 -1.414 . . . . 1.78 107.182 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -122.09 67.34 0.92 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 107.284 -1.376 . . . . 0.25 107.284 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 p -63.61 -7.03 6.17 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 107.841 -1.17 . . . . 0.22 107.841 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.19 -20.0 45.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.231 -0.655 . . . . 1.13 109.231 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.544 HG13 ' HB3' ' A' ' 22' ' ' LEU . 78.7 t -110.54 147.69 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 108.881 -0.785 . . . . 0.24 108.881 -178.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.0 mm -100.1 120.51 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.2 -0.937 . . . . 0.15 109.325 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.576 ' C ' HD12 ' A' ' 55' ' ' LEU . 24.4 m-85 -98.38 126.97 44.11 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.168 -0.957 . . . . 0.12 110.393 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -110.31 143.69 40.14 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 108.616 -0.883 . . . . 0.22 108.616 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -112.33 129.4 56.31 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 106.809 -1.552 . . . . 1.13 106.809 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.5 t -126.93 133.39 68.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.237 -0.914 . . . . 0.15 110.495 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.521 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 51.5 t0 -96.92 120.07 36.58 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.848 -0.797 . . . . 1.05 108.848 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.92 -18.88 24.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.592 -1.318 . . . . 0.16 107.739 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.2 m-20 -90.45 -43.89 9.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.504 -0.747 . . . . 1.08 111.599 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 23.9 m-20 -95.75 -19.04 19.97 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.625 -1.297 . . . . 1.07 108.81 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -119.61 38.75 3.8 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.641 -1.244 . . . . 0.14 107.641 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -60.08 -22.56 62.89 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.835 -0.541 . . . . 1.47 109.933 -178.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.617 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.4 p30 -65.42 -38.32 89.57 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.76 -1.213 . . . . 1.05 108.84 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.617 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -71.41 -44.03 72.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 O-C-N 121.234 -0.916 . . . . 0.35 109.647 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.52 73.59 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.442 -0.787 . . . . 0.26 110.438 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -60.83 -34.0 73.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.922 -1.111 . . . . 0.24 109.446 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -62.47 -37.77 87.26 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.882 . . . . 2.06 109.184 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.25 0.02 57.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.347 -0.845 . . . . 0.23 110.929 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 mp0 53.61 49.85 18.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.946 -1.096 . . . . 2.02 109.025 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.08 134.18 29.12 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 O-C-N 121.0 -1.063 . . . . 0.16 108.441 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -105.44 -12.78 15.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.584 -0.698 . . . . 1.6 110.339 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.61 154.44 18.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.819 -1.176 . . . . 0.14 111.116 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -125.8 156.11 71.73 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.359 -1.349 . . . . 0.15 107.359 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -77.66 142.77 72.11 Favored 'Cis proline' 0 C--N 1.316 -1.17 0 C-N-CA 123.644 -1.399 . . . . 0.16 112.074 -2.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.9 134.04 48.11 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 109.245 -0.65 . . . . 0.13 109.245 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.535 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 90.9 m-85 -110.7 130.49 55.56 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.72 -0.845 . . . . 0.2 108.72 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -120.63 140.26 51.81 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.397 -0.964 . . . . 0.29 108.397 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.424 ' CE1' HG21 ' A' ' 100' ' ' THR . 76.0 m-85 -107.71 132.12 53.7 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.466 0.651 . . . . 0.14 110.388 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -125.79 144.11 50.78 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.803 -0.814 . . . . 0.15 108.803 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -147.07 128.51 14.96 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.208 -1.404 . . . . 1.68 107.208 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 mttt 60.01 28.03 17.51 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.129 -1.063 . . . . 1.22 108.129 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.19 21.66 75.32 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 110.133 -1.187 . . . . 0.23 110.133 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -128.72 137.75 51.76 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.291 -1.123 . . . . 2.07 111.012 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -77.43 125.3 29.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.46 -0.775 . . . . 1.82 109.63 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -123.97 9.1 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.617 -0.677 . . . . 0.3 110.887 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.62 154.47 12.31 Favored Glycine 0 N--CA 1.496 2.695 0 C-N-CA 118.424 -1.846 . . . . 0.17 111.538 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -166.54 150.34 7.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.635 -0.921 . . . . 1.93 109.488 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.4 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 27.0 p90 -164.33 161.94 22.05 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.273 -0.971 . . . . 0.14 109.159 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -126.64 159.96 32.1 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.669 0.747 . . . . 0.12 109.539 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.439 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.09 142.85 6.38 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.897 -1.681 . . . . 0.12 108.897 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.98 67.86 4.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.151 -1.205 . . . . 0.18 110.142 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.51 97.19 5.53 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.417 -0.957 . . . . 0.88 108.417 178.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -35.43 77.4 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.098 -1.001 . . . . 1.06 111.335 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -61.81 -29.95 70.5 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.982 -1.074 . . . . 1.61 109.388 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -62.46 -33.61 75.16 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.75 -0.594 . . . . 1.45 109.404 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.42 HD21 ' CD1' ' A' ' 77' ' ' PHE . 38.5 mt -59.27 -39.72 83.8 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.974 -1.121 . . . . 0.19 107.974 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.88 -44.06 97.62 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.456 -0.898 . . . . 2.1 110.907 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.89 75.32 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.89 -1.131 . . . . 0.19 110.732 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.424 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.8 m -64.75 -40.59 95.55 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.833 -1.167 . . . . 0.2 109.015 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 77.6 mt -64.46 -47.85 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 N-CA-C 107.586 -1.264 . . . . 0.16 107.586 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.441 ' O ' HG12 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -59.99 -36.4 77.11 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.48 -0.933 . . . . 0.95 108.48 178.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -69.33 -40.23 77.71 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.684 -0.635 . . . . 2.21 110.483 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HB2' HD11 ' A' ' 22' ' ' LEU . 94.2 mt -98.22 -2.91 38.61 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.245 -0.91 . . . . 0.25 111.554 -178.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.418 -1.426 . . . . 1.08 109.289 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.6 mmtt . . . . . 0 N--CA 1.489 1.524 0 N-CA-C 108.754 -0.832 . . . . 1.31 108.754 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.439 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.6 mm -130.22 140.36 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 109.375 -0.602 . . . . 0.15 109.375 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.8 m -100.83 130.06 46.79 Favored 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 106.779 -1.563 . . . . 0.19 106.779 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.1 m -81.99 145.57 30.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.664 -1.272 . . . . 0.2 111.509 -177.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.403 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.7 m95 -80.0 -17.75 52.04 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.411 -0.806 . . . . 0.21 109.563 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.412 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.2 m120 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 108.176 -1.046 . . . . 0.49 108.176 179.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.1 tptp . . . . . 0 N--CA 1.498 1.957 0 N-CA-C 108.916 -0.772 . . . . 1.67 108.916 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.423 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 66.3 tt0 -96.52 124.48 40.52 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.777 -1.194 . . . . 0.31 107.777 178.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.9 mm -102.03 115.06 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 0.19 108.893 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.423 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 30.9 mm-40 -99.17 -1.58 38.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.289 -0.882 . . . . 2.25 109.279 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 78.9 p -150.13 152.7 35.14 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.13 -0.981 . . . . 0.15 110.993 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.461 ' NZ ' ' CB ' ' A' ' 8' ' ' LYS . 2.9 ttmp? -62.83 -31.02 71.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.54 -0.911 . . . . 1.65 108.54 178.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.6 m -58.16 -48.62 79.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.106 -0.996 . . . . 0.23 109.495 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.06 70.56 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.257 -0.902 . . . . 0.17 108.872 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.531 ' CE2' HD11 ' A' ' 15' ' ' LEU . 50.1 t80 -59.79 -44.3 93.99 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.825 . . . . 0.14 109.183 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -65.6 -42.35 91.77 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.69 0.757 . . . . 1.31 109.166 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -64.23 -39.1 93.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.641 -0.662 . . . . 1.77 110.226 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.54 85.13 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.417 -0.802 . . . . 0.15 109.029 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.531 HD11 ' CE2' ' A' ' 11' ' ' PHE . 71.4 mt -60.62 -40.15 90.8 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.239 -0.985 . . . . 0.17 108.357 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -69.52 -36.7 76.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.235 -0.916 . . . . 1.07 109.872 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.95 -36.51 78.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.299 -0.876 . . . . 0.18 110.335 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.75 -33.59 75.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.263 -0.898 . . . . 0.17 109.383 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -124.58 20.44 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.345 -1.102 . . . . 0.2 110.345 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -92.52 3.12 56.12 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.124 -1.221 . . . . 1.07 110.83 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -75.14 150.74 38.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.106 -0.996 . . . . 1.5 108.767 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.694 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.38 155.54 24.93 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.823 -1.177 . . . . 0.47 107.823 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.694 ' H ' HD23 ' A' ' 22' ' ' LEU . 46.8 t -142.84 113.17 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 121.128 -0.983 . . . . 0.17 108.695 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -102.08 140.97 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 107.908 -1.145 . . . . 0.14 107.908 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.98 123.68 67.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.351 -0.843 . . . . 0.13 109.572 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.529 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.4 t70 -100.62 109.25 21.31 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.573 -0.704 . . . . 1.05 110.922 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -91.0 101.28 14.05 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 106.575 -1.639 . . . . 0.73 106.575 176.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -128.14 146.48 50.69 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.326 -0.99 . . . . 0.3 108.326 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.564 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.95 123.63 30.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.164 -1.421 . . . . 0.22 107.164 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.0 -32.09 73.08 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 118.522 -1.271 . . . . 0.3 108.545 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.564 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.2 p-90 -70.57 -26.16 63.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.257 -0.902 . . . . 0.26 110.636 179.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -83.78 115.98 22.49 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.959 -1.088 . . . . 0.26 108.134 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.468 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -63.28 -50.05 65.85 Favored Glycine 0 N--CA 1.489 2.182 0 C-N-CA 120.622 -0.799 . . . . 0.23 111.713 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 38.6 Cg_exo -52.13 -35.88 64.17 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 CA-C-N 118.913 1.357 . . . . 0.31 111.98 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.81 -53.83 7.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.434 -0.792 . . . . 0.24 110.029 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ttpp -61.11 -37.21 81.96 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.06 -1.025 . . . . 1.59 109.867 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.497 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.6 tmm? -59.2 -28.17 66.41 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.569 -0.707 . . . . 2.1 109.878 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 38' ' ' ILE . 72.9 mt -81.69 -3.86 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.838 -0.539 . . . . 0.49 111.332 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -64.88 -27.6 2.37 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 120.368 -1.458 . . . . 0.8 113.865 -178.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.2 Cg_exo -56.15 -40.69 83.23 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 CA-C-N 122.215 1.827 . . . . 0.28 112.604 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -67.92 -45.21 75.01 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 117.817 -1.553 . . . . 0.37 107.877 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -60.29 -53.43 57.79 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.255 -0.903 . . . . 0.16 110.177 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -68.23 -40.09 82.13 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.517 -0.739 . . . . 0.32 110.598 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 70.0 m -62.21 -38.96 91.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.093 -1.004 . . . . 0.22 110.096 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.13 -27.28 68.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.174 -0.954 . . . . 0.22 110.105 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.7 m -50.72 -38.48 47.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.864 -1.147 . . . . 0.16 109.424 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -83.3 -13.17 55.72 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.967 -1.083 . . . . 2.16 109.377 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.457 ' HZ2' ' HB2' ' A' ' 48' ' ' LYS . 4.4 ttmp? -82.05 -36.91 27.22 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.705 -1.22 . . . . 1.78 107.705 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -123.44 65.82 1.01 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 106.509 -1.663 . . . . 0.25 106.509 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.9 p -62.56 -8.87 7.12 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.154 -1.054 . . . . 0.22 108.154 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -89.9 8.44 32.18 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 1.13 108.48 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.2 t -127.27 148.93 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 107.698 -1.223 . . . . 0.24 107.698 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' CD1' ' A' ' 55' ' ' LEU . 21.9 mm -99.88 121.08 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.049 -1.032 . . . . 0.15 109.945 -178.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.525 ' C ' HD12 ' A' ' 55' ' ' LEU . 55.6 m-85 -104.45 124.6 49.54 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.201 -0.937 . . . . 0.12 109.909 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.525 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.9 mp -110.5 143.62 40.58 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.952 -1.092 . . . . 0.22 109.833 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -112.8 130.05 56.22 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.74 -1.578 . . . . 1.13 106.74 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.08 140.43 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.916 0.865 . . . . 0.15 111.537 -177.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.489 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.3 t0 -102.7 118.07 36.03 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.633 -0.877 . . . . 1.05 108.633 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.0 m -69.73 -15.09 19.04 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 120.697 -1.252 . . . . 0.16 108.794 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.403 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.6 m-20 -95.42 -41.69 8.86 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.457 -0.777 . . . . 1.08 111.047 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 59.1 m-20 -97.53 -18.66 18.85 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.072 -1.018 . . . . 1.07 108.552 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.66 39.15 4.0 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 107.223 -1.399 . . . . 0.14 107.223 178.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.785 HE21 ' H ' ' A' ' 64' ' ' ASP . 1.6 pm0 -60.16 -22.96 63.53 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.779 -0.646 . . . . 1.47 110.019 -178.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.785 ' H ' HE21 ' A' ' 63' ' ' GLN . 2.1 p30 -63.2 -36.21 82.87 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.943 -1.098 . . . . 1.05 109.202 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.632 HG23 ' OD1' ' A' ' 64' ' ' ASP . 13.8 t -73.64 -43.91 53.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.465 -0.772 . . . . 0.35 109.71 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.33 -39.06 68.47 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.768 -0.582 . . . . 0.26 111.309 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.3 p -60.21 -38.78 84.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.978 -1.076 . . . . 0.24 109.946 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.91 -36.5 84.13 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 2.06 109.206 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.03 -0.63 55.07 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.395 -0.816 . . . . 0.23 111.194 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.69 49.84 17.16 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.939 -1.101 . . . . 2.02 109.785 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.6 t -65.38 130.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 C-N-CA 118.329 -1.348 . . . . 0.16 108.276 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -102.15 -12.71 17.85 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.72 -0.613 . . . . 1.6 110.237 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.477 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.82 156.21 17.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.746 -1.221 . . . . 0.14 110.814 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.42 HG23 ' NE1' ' B' ' 67' ' ' TRP . 36.6 p -129.74 154.27 80.96 Favored Pre-proline 0 N--CA 1.504 2.23 0 N-CA-C 108.06 -1.089 . . . . 0.15 108.06 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -74.8 144.95 82.59 Favored 'Cis proline' 0 N--CA 1.496 1.665 0 C-N-CA 123.811 -1.329 . . . . 0.16 112.435 -2.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -130.33 136.12 48.79 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 108.57 -0.9 . . . . 0.13 108.57 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.84 ' CD1' HD21 ' A' ' 97' ' ' LEU . 88.5 m-85 -109.68 129.54 55.59 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.663 -0.648 . . . . 0.2 109.313 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -121.96 137.58 54.74 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.683 -0.858 . . . . 0.29 108.683 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -105.26 133.77 49.48 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.735 -0.603 . . . . 0.14 110.271 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -127.43 143.96 51.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.15 109.357 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -145.92 127.13 14.77 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 107.868 -1.16 . . . . 1.68 107.868 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.2 mttt 59.75 28.51 17.98 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.211 -1.033 . . . . 1.22 108.211 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.07 22.52 73.79 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.757 -1.337 . . . . 0.23 109.757 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -127.75 137.26 52.37 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.347 -1.09 . . . . 2.07 110.61 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -81.04 126.31 31.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.202 -0.936 . . . . 1.82 109.76 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.26 8.33 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.671 -0.643 . . . . 0.3 110.399 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.89 155.98 16.86 Favored Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.626 -1.749 . . . . 0.17 111.815 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -166.16 149.18 7.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.92 -0.753 . . . . 1.93 109.454 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.42 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 20.6 p90 -164.15 160.68 21.68 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.08 -1.048 . . . . 0.14 109.459 177.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -124.96 162.79 23.72 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.615 0.722 . . . . 0.12 109.86 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.523 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.55 137.57 5.53 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.135 -1.586 . . . . 0.12 109.135 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.469 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.02 67.78 2.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.179 -1.189 . . . . 0.18 110.232 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -119.21 100.12 7.13 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.256 -1.016 . . . . 0.88 108.256 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.89 -34.7 73.89 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.492 -0.755 . . . . 1.06 112.36 -178.413 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.03 -29.89 71.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.538 -1.351 . . . . 1.61 109.553 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.83 -38.38 81.87 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.926 -0.768 . . . . 1.45 108.926 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.84 HD21 ' CD1' ' A' ' 77' ' ' PHE . 42.9 mt -57.76 -39.88 78.43 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.853 0.835 . . . . 0.19 108.929 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.81 -41.59 99.36 Favored 'General case' 0 C--N 1.293 -1.873 0 C-N-CA 119.825 -0.75 . . . . 2.1 110.611 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.01 77.28 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.106 -0.996 . . . . 0.19 111.861 -178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -39.58 93.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 120.544 -1.348 . . . . 0.2 109.67 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.5 mt -61.05 -49.9 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.101 -0.999 . . . . 0.16 108.818 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 105' ' ' VAL . 24.0 t-20 -60.18 -34.39 73.53 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.32 -0.992 . . . . 0.95 108.32 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -67.83 -38.5 83.28 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.696 -0.627 . . . . 2.21 109.752 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.621 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.5 mt -101.99 -0.13 34.23 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.299 -0.875 . . . . 0.25 111.56 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.3 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 1.08 109.232 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.1 mmtt . . . . . 0 N--CA 1.489 1.51 0 N-CA-C 109.49 -0.559 . . . . 1.31 109.49 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.523 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.1 mm -130.25 140.47 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.865 -0.522 . . . . 0.15 110.057 -179.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 59.9 m -98.15 124.64 42.8 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 107.325 -1.361 . . . . 0.19 107.325 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 60.9 m -77.65 141.55 39.36 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.942 -1.098 . . . . 0.2 111.575 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.42 ' NE1' HG23 ' A' ' 74' ' ' THR . 21.5 m95 -76.38 -9.57 58.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.21 109.274 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.466 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.9 m120 . . . . . 0 N--CA 1.487 1.38 0 O-C-N 121.109 -0.994 . . . . 0.49 108.715 -179.893 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.9 tptt . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 108.617 -0.883 . . . . 1.67 108.617 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -99.35 122.86 43.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.348 -0.845 . . . . 0.31 108.886 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.69 115.25 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.372 -0.83 . . . . 0.19 108.792 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.457 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 53.4 mp0 -97.52 -0.71 45.5 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.376 -0.827 . . . . 2.25 109.415 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -154.0 153.11 31.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.021 -1.049 . . . . 0.15 111.198 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.84 -32.4 73.61 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.445 -0.946 . . . . 1.65 108.445 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.3 m -58.96 -46.44 88.06 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.999 -1.111 . . . . 0.23 107.999 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.92 -30.7 69.22 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.634 -0.876 . . . . 0.17 108.634 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.515 ' CE2' HD11 ' A' ' 15' ' ' LEU . 53.7 t80 -59.83 -43.79 94.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.109 -0.994 . . . . 0.14 108.964 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -65.36 -41.29 94.0 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.831 -0.803 . . . . 1.31 108.831 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.9 -35.34 79.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.663 -0.648 . . . . 1.77 110.237 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.81 82.92 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.284 -0.885 . . . . 0.15 109.234 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.515 HD11 ' CE2' ' A' ' 11' ' ' PHE . 69.3 mt -61.52 -40.39 94.45 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.334 -0.854 . . . . 0.17 108.807 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -70.05 -36.83 75.29 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.417 -0.802 . . . . 1.07 110.185 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.11 90.14 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.361 -0.837 . . . . 0.18 110.338 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -32.66 71.52 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.381 -0.824 . . . . 0.17 109.847 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.08 -126.8 23.75 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.31 -1.116 . . . . 0.2 110.31 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -91.75 5.27 50.45 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.892 -1.358 . . . . 1.07 110.978 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -77.58 151.83 34.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.128 -0.983 . . . . 1.5 109.469 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.677 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -61.03 156.91 16.76 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.489 -1.3 . . . . 0.47 107.489 179.78 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.675 ' H ' HD23 ' A' ' 22' ' ' LEU . 77.8 t -143.75 117.99 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.856 -1.153 . . . . 0.17 108.859 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.0 142.08 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 107.813 -1.18 . . . . 0.14 107.813 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.45 123.76 66.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.351 -0.843 . . . . 0.13 109.205 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.473 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.1 t70 -100.82 118.1 36.22 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.473 -0.767 . . . . 1.05 109.633 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -95.18 22.8 6.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.306 -0.871 . . . . 0.73 109.902 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.3 m -59.04 148.01 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.027 -1.045 . . . . 0.3 110.779 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.583 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.13 123.82 32.6 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.074 -1.084 . . . . 0.22 108.074 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.0 t -65.26 -34.51 78.52 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 118.916 -1.114 . . . . 0.3 108.192 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.583 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.0 p-90 -70.12 -23.28 63.0 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.218 -0.927 . . . . 0.26 111.003 179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.2 t -82.68 112.89 19.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.734 -1.229 . . . . 0.26 107.992 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.455 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.85 -50.58 66.17 Favored Glycine 0 N--CA 1.489 2.211 0 C-N-CA 120.329 -0.939 . . . . 0.23 111.246 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.1 Cg_exo -51.45 -37.82 62.51 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 CA-C-N 119.011 1.406 . . . . 0.31 111.958 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.444 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.49 -47.5 19.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.057 -1.027 . . . . 0.24 109.909 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.54 -31.52 69.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.135 -0.978 . . . . 1.59 109.127 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.511 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -59.91 -29.74 68.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.473 -0.767 . . . . 2.1 109.967 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.558 HD11 ' HB1' ' A' ' 92' ' ' ALA . 15.5 mt -80.78 -5.07 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.523 -0.736 . . . . 0.49 111.325 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.526 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.28 -31.52 9.36 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 119.988 -1.695 . . . . 0.8 113.669 -176.857 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -59.9 -37.46 85.66 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 CA-C-N 121.898 1.714 . . . . 0.28 112.067 -178.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -71.62 -51.4 23.41 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 118.371 -1.332 . . . . 0.37 108.175 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.87 -46.7 88.46 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.38 -0.825 . . . . 0.16 109.039 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.14 -45.65 73.02 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.493 -0.755 . . . . 0.32 110.846 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.7 m -61.62 -39.92 93.0 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.085 -1.009 . . . . 0.22 111.154 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.6 mt -61.33 -22.31 64.79 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.269 -0.894 . . . . 0.22 110.852 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -55.51 -38.25 68.96 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 120.981 -1.074 . . . . 0.16 108.714 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -86.21 -16.66 37.03 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.251 -0.905 . . . . 2.16 109.263 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -76.58 -35.75 57.96 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.325 -1.361 . . . . 1.78 107.325 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -123.9 67.92 1.04 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 107.552 -1.277 . . . . 0.25 107.552 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.7 p -64.06 -7.73 9.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.578 -0.897 . . . . 0.22 108.578 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -89.16 5.48 44.46 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.115 -1.069 . . . . 1.13 108.115 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.473 HG13 ' HB3' ' A' ' 22' ' ' LEU . 44.4 t -128.0 143.08 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 N-CA-C 107.605 -1.257 . . . . 0.24 107.605 178.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.5 mm -99.21 122.55 51.1 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.913 -1.117 . . . . 0.15 109.203 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.599 ' C ' HD12 ' A' ' 55' ' ' LEU . 29.8 m-85 -100.76 129.01 46.59 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.298 -0.876 . . . . 0.12 109.219 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.599 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -112.52 141.52 46.19 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.357 -0.839 . . . . 0.22 109.138 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -109.94 132.62 53.99 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.673 -1.603 . . . . 1.13 106.673 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -130.45 132.0 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.27 -0.894 . . . . 0.15 110.26 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.665 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.6 t0 -95.64 120.96 36.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 1.05 108.52 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.87 -20.52 26.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 120.659 -1.276 . . . . 0.16 107.989 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.543 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.1 m-20 -90.25 -43.2 10.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.618 -0.676 . . . . 1.08 111.506 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.411 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 72.4 m-20 -95.75 -14.2 23.54 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.561 -1.337 . . . . 1.07 108.237 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.665 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 39.72 3.9 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.21 -1.404 . . . . 0.14 107.21 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -60.08 -26.93 66.58 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.628 -0.67 . . . . 1.47 109.362 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.537 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -65.33 -37.48 87.21 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.029 -1.044 . . . . 1.05 108.969 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.537 HG23 ' OD1' ' A' ' 64' ' ' ASP . 7.6 t -70.28 -47.26 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.236 -0.915 . . . . 0.35 109.797 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.33 -36.92 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.446 -0.784 . . . . 0.26 110.788 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -61.07 -32.59 72.23 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.027 -1.046 . . . . 0.24 109.57 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.9 -35.73 80.68 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.246 -0.908 . . . . 2.06 109.283 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.467 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -88.02 -0.22 56.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.281 -0.887 . . . . 0.23 110.857 -178.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 54.62 50.06 16.77 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.056 -1.027 . . . . 2.02 109.954 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.2 t -67.45 132.38 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 120.938 -1.101 . . . . 0.16 108.731 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -104.6 -12.63 16.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.671 -0.643 . . . . 1.6 110.66 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.8 153.42 16.77 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.499 -1.376 . . . . 0.14 110.841 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -124.84 155.26 70.43 Favored Pre-proline 0 N--CA 1.501 2.122 0 N-CA-C 108.038 -1.097 . . . . 0.15 108.038 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -76.44 143.16 75.38 Favored 'Cis proline' 0 N--CA 1.493 1.457 0 C-N-CA 123.844 -1.315 . . . . 0.16 112.538 -2.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.9 m -128.97 136.12 49.92 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.11 -0.7 . . . . 0.13 109.11 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.756 ' CD1' HD21 ' A' ' 97' ' ' LEU . 93.8 m-85 -112.01 129.64 56.13 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.778 -0.823 . . . . 0.2 108.778 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.467 HE22 ' HB1' ' A' ' 69' ' ' ALA . 63.0 mt-30 -121.49 137.75 54.59 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.843 -1.169 . . . . 0.29 107.843 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -105.56 134.59 48.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.722 -0.611 . . . . 0.14 110.978 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -128.1 148.99 50.6 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.47 0.653 . . . . 0.15 109.546 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -150.74 125.62 9.79 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.74 -1.207 . . . . 1.68 107.74 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 55.1 mttp 60.03 28.17 17.68 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 108.956 -0.757 . . . . 1.22 108.956 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.2 21.46 70.38 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.113 -1.195 . . . . 0.23 110.113 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -129.51 140.21 51.32 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.328 -1.101 . . . . 2.07 110.596 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -77.79 129.12 35.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.551 -0.718 . . . . 1.82 109.063 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.4 m -123.24 8.03 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.683 -0.636 . . . . 0.3 110.39 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.81 14.6 Favored Glycine 0 N--CA 1.497 2.704 0 C-N-CA 118.433 -1.842 . . . . 0.17 112.059 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -164.13 149.44 10.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 122.005 -0.703 . . . . 1.93 109.87 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 8.2 p90 -163.81 159.57 21.37 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.389 -0.82 . . . . 0.14 109.967 177.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.4 p -126.2 160.46 30.2 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.867 0.842 . . . . 0.12 110.253 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.492 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.34 140.78 5.6 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.652 -1.779 . . . . 0.12 108.652 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.558 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.32 62.91 3.8 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.184 -1.186 . . . . 0.18 110.193 -179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.4 t-20 -117.48 101.82 8.69 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.89 -1.152 . . . . 0.88 107.89 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.453 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.32 -31.45 69.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.484 -0.76 . . . . 1.06 111.747 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.94 -29.56 69.46 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.721 -1.237 . . . . 1.61 109.551 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.429 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 74.4 tttt -60.07 -34.09 72.97 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 108.353 -0.98 . . . . 1.45 108.353 -179.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.756 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.1 mt -59.87 -40.04 87.3 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.61 -0.885 . . . . 0.19 108.61 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -63.09 -42.4 99.61 Favored 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.916 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.55 78.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.185 -0.947 . . . . 0.19 111.278 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.04 -39.31 90.06 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 120.753 -1.217 . . . . 0.2 109.873 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.4 mt -61.38 -47.49 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.001 -1.062 . . . . 0.16 108.511 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.499 ' O ' HG12 ' A' ' 105' ' ' VAL . 18.9 t-20 -60.41 -35.63 76.24 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 121.821 0.82 . . . . 0.95 108.922 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.29 -39.72 86.01 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.75 -0.594 . . . . 2.21 109.886 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 22' ' ' LEU . 73.4 mt -99.35 -2.65 35.78 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.236 -0.915 . . . . 0.25 111.046 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.3 p . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.521 -1.362 . . . . 1.08 109.019 -179.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 28.9 mmtp . . . . . 0 N--CA 1.49 1.544 0 N-CA-C 109.283 -0.636 . . . . 1.31 109.283 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.492 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.1 mm -129.29 140.1 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 121.813 -0.555 . . . . 0.15 109.821 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.6 m -101.64 132.15 47.47 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.725 -1.213 . . . . 0.19 107.725 178.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.0 m -81.66 141.55 33.54 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.726 -1.234 . . . . 0.2 110.994 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.465 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.6 m95 -76.21 -12.55 60.11 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.292 -0.88 . . . . 0.21 108.904 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 m120 . . . . . 0 C--N 1.303 -1.43 0 N-CA-C 108.36 -0.978 . . . . 0.49 108.36 179.61 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.4 tptt . . . . . 0 N--CA 1.493 1.722 0 N-CA-C 107.83 -1.174 . . . . 1.67 107.83 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -96.55 122.62 39.66 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.847 -0.798 . . . . 0.31 108.847 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.9 111.95 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 108.487 -0.931 . . . . 0.19 108.487 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.458 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.9 mp0 -95.65 -0.44 51.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.138 -0.976 . . . . 2.25 109.844 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.58 156.3 34.85 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.79 -1.194 . . . . 0.15 111.782 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -61.87 -31.7 71.99 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.225 -1.028 . . . . 1.65 108.225 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.408 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 60.0 m -58.51 -49.91 75.67 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.503 -0.879 . . . . 0.23 108.818 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.03 67.59 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.933 -0.766 . . . . 0.17 108.933 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.579 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.9 t80 -59.75 -44.52 93.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 0.14 109.351 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -65.01 -44.02 90.56 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.424 -0.797 . . . . 1.31 109.305 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.533 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.84 -39.45 94.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.704 -0.623 . . . . 1.77 110.414 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.19 95.36 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.374 -0.829 . . . . 0.15 109.057 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.579 HD11 ' CE2' ' A' ' 11' ' ' PHE . 35.6 mt -60.25 -41.06 92.42 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.315 -0.866 . . . . 0.17 109.011 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -70.02 -36.16 74.87 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.359 -0.838 . . . . 1.07 110.474 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.46 78.71 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.132 -0.98 . . . . 0.18 110.965 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.62 -31.48 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.897 -1.127 . . . . 0.17 109.675 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.95 -124.67 20.83 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.989 -1.244 . . . . 0.2 109.989 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.426 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 65.2 m-20 -91.85 0.33 57.49 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.999 -1.294 . . . . 1.07 110.706 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -74.78 150.1 39.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.838 -1.164 . . . . 1.5 109.646 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 22' ' ' LEU . 8.2 mt -57.39 159.94 4.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.961 -1.087 . . . . 0.47 109.316 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.1 t -146.65 107.92 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 108.102 -1.073 . . . . 0.17 108.102 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.449 HG22 ' CD2' ' A' ' 79' ' ' PHE . 47.6 t -102.46 136.26 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 N-CA-C 107.595 -1.261 . . . . 0.14 107.595 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.9 t -118.18 123.05 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.201 -0.937 . . . . 0.13 109.742 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -98.97 119.78 38.31 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 1.05 109.928 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -97.85 24.91 6.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.23 -0.919 . . . . 0.73 110.401 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -59.88 148.26 35.49 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.036 -1.04 . . . . 0.3 110.403 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.587 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.39 124.54 32.11 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.687 -1.227 . . . . 0.22 107.687 178.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.09 -33.61 74.86 Favored 'General case' 0 C--N 1.298 -1.638 0 C-N-CA 118.877 -1.129 . . . . 0.3 108.703 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.587 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.4 p-90 -69.95 -21.63 63.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.147 -0.971 . . . . 0.26 110.447 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.1 t -84.59 112.01 20.04 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.974 -1.079 . . . . 0.26 108.342 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.431 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.92 -52.05 55.57 Favored Glycine 0 N--CA 1.491 2.349 0 C-N-CA 120.862 -0.685 . . . . 0.23 111.64 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -51.23 -35.28 52.21 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 CA-C-N 119.062 1.431 . . . . 0.31 111.72 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.66 17.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.587 -0.696 . . . . 0.24 109.816 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.0 -32.15 70.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.28 -0.887 . . . . 1.59 109.533 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 19.1 ttt -59.81 -27.76 66.87 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 2.1 108.998 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.405 HG22 ' O ' ' A' ' 38' ' ' ILE . 19.5 mt -82.2 -7.72 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.782 -0.574 . . . . 0.49 111.868 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.93 -31.13 8.6 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 119.858 -1.776 . . . . 0.8 114.168 -177.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.9 Cg_exo -58.61 -38.61 88.63 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.616 1.613 . . . . 0.28 112.579 -178.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -69.29 -51.07 40.9 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 118.773 -1.171 . . . . 0.37 108.954 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.63 -50.81 72.44 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.248 -0.908 . . . . 0.16 109.508 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -67.47 -44.24 79.07 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.744 -0.597 . . . . 0.32 111.522 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.453 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.5 -37.1 84.73 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.953 -1.092 . . . . 0.22 110.496 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.73 -25.42 67.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.22 110.315 -178.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.0 m -51.62 -38.35 54.27 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.075 -1.016 . . . . 0.16 108.633 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -85.87 -17.03 36.72 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.4 -0.812 . . . . 2.16 109.415 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -77.66 -37.34 50.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 107.594 -1.261 . . . . 1.78 107.594 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -121.85 67.25 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 106.699 -1.593 . . . . 0.25 106.699 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.5 p -63.44 -10.1 15.74 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.856 -0.794 . . . . 0.22 108.856 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -90.99 8.84 33.26 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.6 -0.889 . . . . 1.13 108.6 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 70.0 t -127.12 145.72 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 107.406 -1.331 . . . . 0.24 107.406 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.31 120.61 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 120.978 -1.076 . . . . 0.15 109.989 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.5 ' C ' HD12 ' A' ' 55' ' ' LEU . 47.6 m-85 -102.96 127.78 50.05 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.006 -1.059 . . . . 0.12 109.891 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.5 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -110.06 141.4 42.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.984 -1.073 . . . . 0.22 109.489 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -110.14 132.88 53.77 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.316 -1.364 . . . . 1.13 107.316 178.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 39.6 t -130.23 131.92 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.157 -0.964 . . . . 0.15 110.839 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.617 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.9 t0 -95.2 119.97 34.62 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.135 -1.061 . . . . 1.05 108.135 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.11 -20.1 25.37 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 C-N-CA 118.749 -1.181 . . . . 0.16 108.532 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.9 m-20 -91.72 -41.36 10.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.486 -0.759 . . . . 1.08 111.806 -178.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -95.91 -14.78 22.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 120.408 -1.433 . . . . 1.07 108.236 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.98 38.9 4.09 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.601 -1.259 . . . . 0.14 107.601 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -59.84 -26.58 65.92 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 109.414 -0.587 . . . . 1.47 109.414 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.12 -36.29 83.56 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.804 -1.185 . . . . 1.05 109.495 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.461 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.2 t -73.26 -43.12 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 120.961 -1.087 . . . . 0.35 109.694 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.9 -37.83 67.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.379 -0.826 . . . . 0.26 110.394 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 84.8 p -60.99 -33.91 73.98 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.09 -1.007 . . . . 0.24 108.467 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -60.64 -40.02 90.41 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.538 -0.726 . . . . 2.06 109.056 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.18 4.58 50.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.331 -0.856 . . . . 0.23 110.869 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 52.25 50.13 19.06 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.884 -1.135 . . . . 2.02 110.545 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.35 132.13 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.778 -1.201 . . . . 0.16 108.87 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -103.92 -9.89 18.58 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.719 -0.613 . . . . 1.6 109.611 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.516 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.45 155.79 20.33 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.772 -1.205 . . . . 0.14 111.772 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -126.04 154.3 73.98 Favored Pre-proline 0 N--CA 1.499 1.976 0 N-CA-C 107.566 -1.272 . . . . 0.15 107.566 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -78.86 140.06 56.93 Favored 'Cis proline' 0 N--CA 1.487 1.144 0 C-N-CA 123.657 -1.393 . . . . 0.16 111.97 -2.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -124.22 132.89 53.63 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.885 -0.783 . . . . 0.13 108.885 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.524 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.6 m-85 -110.67 131.48 55.01 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.938 -0.764 . . . . 0.2 108.938 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -121.63 140.4 52.31 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.605 -0.887 . . . . 0.29 108.605 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.449 ' CD2' HG22 ' A' ' 24' ' ' VAL . 66.5 m-85 -107.87 131.15 54.8 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.397 0.617 . . . . 0.14 109.679 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -125.62 148.98 48.78 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 109.082 -0.71 . . . . 0.15 109.082 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -147.31 127.74 14.03 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.182 -1.414 . . . . 1.68 107.182 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.426 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 40.4 mttm 56.09 33.26 21.62 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.057 -1.027 . . . . 1.22 108.89 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.56 24.72 76.45 Favored Glycine 0 N--CA 1.484 1.883 0 N-CA-C 109.82 -1.312 . . . . 0.23 109.82 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.1 mm100 -129.23 135.92 49.43 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.513 -0.993 . . . . 2.07 110.809 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -73.69 129.99 39.07 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.093 -1.004 . . . . 1.82 109.651 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.0 10.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.864 -0.523 . . . . 0.3 110.09 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 164.01 161.78 13.77 Favored Glycine 0 N--CA 1.496 2.658 0 C-N-CA 118.373 -1.87 . . . . 0.17 112.051 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -165.25 154.65 12.65 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.872 -0.781 . . . . 1.93 109.325 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 5.8 p90 -166.92 157.03 11.38 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.886 -0.726 . . . . 0.14 109.355 178.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -125.54 160.91 28.38 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.608 -0.682 . . . . 0.12 109.418 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.461 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.7 143.34 6.11 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.532 -1.827 . . . . 0.12 108.532 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.15 64.04 4.85 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.171 -1.193 . . . . 0.18 109.146 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.83 98.4 6.48 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 108.336 -0.987 . . . . 0.88 108.336 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -34.77 72.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.448 -0.782 . . . . 1.06 111.312 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -62.57 -29.37 70.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.206 -0.934 . . . . 1.61 109.257 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -60.9 -37.62 82.87 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.603 -0.686 . . . . 1.45 109.149 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.05 -39.79 83.11 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.232 -1.025 . . . . 0.19 108.232 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.37 -44.01 96.02 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.051 -0.66 . . . . 2.1 110.503 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.64 -44.08 62.37 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.966 -1.084 . . . . 0.19 111.318 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.4 m -63.2 -40.03 96.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.644 -1.285 . . . . 0.2 109.739 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 69.2 mt -62.1 -50.09 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.221 -0.924 . . . . 0.16 108.551 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.402 ' O ' HG12 ' A' ' 105' ' ' VAL . 21.9 t-20 -60.87 -34.35 74.48 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 122.023 0.916 . . . . 0.95 108.758 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -67.61 -39.87 84.74 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.525 -0.734 . . . . 2.21 110.208 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 75.8 mt -101.3 -3.13 29.46 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.019 -1.051 . . . . 0.25 111.493 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.6 p . . . . . 0 N--CA 1.5 2.036 0 O-C-N 120.392 -1.442 . . . . 1.08 109.678 -179.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm . . . . . 0 N--CA 1.494 1.744 0 N-CA-C 109.541 -0.54 . . . . 1.31 109.541 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.461 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.9 mm -130.0 140.78 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 N-CA-C 109.592 -0.521 . . . . 0.15 109.592 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 16.9 m -101.61 129.49 47.74 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 107.159 -1.423 . . . . 0.19 107.159 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.5 m -81.15 143.93 32.03 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.887 -1.133 . . . . 0.2 111.802 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.516 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 27.6 m95 -76.79 -10.92 59.71 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.052 -1.03 . . . . 0.21 109.24 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.492 1.657 0 N-CA-C 108.625 -0.88 . . . . 0.49 108.625 179.821 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.5 ttpt . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 108.418 -0.956 . . . . 1.67 108.418 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -94.91 125.31 39.49 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.166 -0.959 . . . . 0.31 109.265 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.4 mm -100.56 116.36 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.404 -0.961 . . . . 0.19 108.404 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -99.64 -2.8 34.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.396 -0.815 . . . . 2.25 109.433 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -152.57 155.99 38.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 119.257 -0.977 . . . . 0.15 111.189 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -62.33 -33.81 75.42 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.924 -1.139 . . . . 1.65 107.924 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.2 m -56.0 -49.39 73.77 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 118.962 -1.095 . . . . 0.23 108.96 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.24 69.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.665 -0.865 . . . . 0.17 108.665 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.55 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.1 t80 -59.77 -43.14 94.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.023 -1.048 . . . . 0.14 109.069 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -65.49 -41.61 93.08 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 108.33 -0.989 . . . . 1.31 108.33 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -66.57 -35.73 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.785 -0.572 . . . . 1.77 109.941 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.919 . . . . 0.15 108.746 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.55 HD11 ' CE2' ' A' ' 11' ' ' PHE . 55.3 mt -61.37 -42.66 99.07 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.419 -0.956 . . . . 0.17 108.419 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -68.49 -37.08 79.79 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.622 -0.674 . . . . 1.07 110.053 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.61 -38.63 84.22 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.336 -0.852 . . . . 0.18 109.64 -179.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.82 69.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.119 -0.988 . . . . 0.17 110.331 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -128.05 26.05 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.276 -1.13 . . . . 0.2 110.276 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -91.65 3.48 54.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.141 -1.211 . . . . 1.07 109.957 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.4 mttp -75.16 149.16 39.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.022 -1.048 . . . . 1.5 109.44 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.08 154.9 18.23 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.752 -1.203 . . . . 0.47 107.752 -179.637 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.611 ' H ' HD23 ' A' ' 22' ' ' LEU . 92.5 t -142.57 109.75 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.996 -1.065 . . . . 0.17 108.99 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.3 t -100.12 141.16 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 107.783 -1.191 . . . . 0.14 107.783 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -123.42 121.69 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 O-C-N 120.893 -1.13 . . . . 0.13 109.978 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.563 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.55 121.72 40.85 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.359 -0.838 . . . . 1.05 110.11 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -97.13 21.36 9.97 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.126 -0.984 . . . . 0.73 110.226 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.408 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 52.3 m -54.16 147.06 13.65 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.045 -1.034 . . . . 0.3 111.306 -178.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.559 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.94 126.19 33.3 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.843 -1.169 . . . . 0.22 107.843 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.413 HG23 ' N ' ' A' ' 31' ' ' TRP . 7.8 t -66.93 -36.56 82.52 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.646 -1.284 . . . . 0.3 108.477 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.559 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.3 p-90 -69.9 -22.6 63.21 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.333 -0.854 . . . . 0.26 111.761 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.9 t -83.77 118.39 23.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.715 -1.241 . . . . 0.26 108.806 -179.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.409 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.06 -54.39 37.14 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 120.1 -1.048 . . . . 0.23 111.074 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 38.5 Cg_exo -50.69 -38.58 56.21 Favored 'Trans proline' 0 C--N 1.309 -1.549 0 CA-C-N 119.074 1.437 . . . . 0.31 111.95 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.72 -49.96 19.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.24 110.504 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -60.42 -38.12 83.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.091 -1.006 . . . . 1.59 109.391 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 22.5 ttt -57.42 -28.61 63.43 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.477 -0.765 . . . . 2.1 110.183 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.56 HG22 ' O ' ' A' ' 38' ' ' ILE . 63.6 mt -85.18 -2.81 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.829 -0.544 . . . . 0.49 111.047 -179.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.572 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 3.4 ptmt -64.16 -29.54 3.99 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 120.111 -1.618 . . . . 0.8 112.979 -178.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.0 Cg_exo -56.62 -41.67 73.4 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 121.525 1.581 . . . . 0.28 113.116 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.536 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 31.3 m-85 -68.15 -44.7 75.43 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.249 -1.532 . . . . 0.37 108.575 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -61.14 -53.9 51.19 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.79 0.805 . . . . 0.16 110.342 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.9 t60 -68.24 -42.27 79.97 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.77 -0.582 . . . . 0.32 111.404 -179.46 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.4 m -60.52 -37.76 82.2 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.102 -0.999 . . . . 0.22 110.692 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 mt -63.15 -21.74 66.4 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.84 -1.163 . . . . 0.22 110.792 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.0 m -51.56 -39.43 57.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.613 -1.304 . . . . 0.16 108.916 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -82.46 -16.5 48.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.434 -0.791 . . . . 2.16 109.598 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -78.28 -36.68 46.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.091 -1.448 . . . . 1.78 107.091 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -124.18 67.85 1.06 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 107.353 -1.351 . . . . 0.25 107.353 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -63.86 -10.44 20.6 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.574 -0.899 . . . . 0.22 108.574 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -89.25 6.16 41.55 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.349 -0.982 . . . . 1.13 108.349 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.488 HG13 ' HB3' ' A' ' 22' ' ' LEU . 43.4 t -126.07 143.67 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 N-CA-C 107.289 -1.374 . . . . 0.24 107.289 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.6 mm -99.89 120.35 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 121.043 -1.036 . . . . 0.15 110.0 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.41 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.0 m-85 -100.83 128.64 46.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.157 -0.965 . . . . 0.12 109.496 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.41 HD12 ' C ' ' A' ' 54' ' ' PHE . 2.8 mp -110.34 140.01 44.97 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 120.945 -1.097 . . . . 0.22 109.771 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -110.1 132.01 54.54 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.777 -1.564 . . . . 1.13 106.777 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -130.13 130.19 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.06 -1.025 . . . . 0.15 110.437 -178.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 47.6 t0 -93.0 121.07 33.96 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.27 -1.011 . . . . 1.05 108.27 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -68.37 -19.0 23.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.689 -1.257 . . . . 0.16 108.362 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.2 m-20 -92.66 -39.83 11.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.45 -0.781 . . . . 1.08 112.126 -179.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -98.02 -14.39 20.57 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.708 -1.245 . . . . 1.07 108.199 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -126.83 39.32 3.94 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 107.586 -1.264 . . . . 0.14 107.586 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -59.79 -23.18 63.07 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 115.748 -0.66 . . . . 1.47 110.097 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.616 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -64.36 -39.99 94.97 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.94 -1.1 . . . . 1.05 109.177 179.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.616 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -69.54 -45.13 78.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 O-C-N 121.125 -0.985 . . . . 0.35 110.108 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.35 69.75 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.623 -0.673 . . . . 0.26 110.699 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.3 p -60.31 -39.43 86.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.936 -1.103 . . . . 0.24 109.981 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -62.88 -37.08 85.48 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.148 -0.97 . . . . 2.06 109.336 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.404 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.64 0.49 50.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.149 -0.97 . . . . 0.23 110.248 -179.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 52.28 50.25 18.79 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.868 -1.145 . . . . 2.02 109.375 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 35.3 t -64.17 134.57 28.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 120.46 -1.4 . . . . 0.16 108.138 -179.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -106.51 -12.38 15.63 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.501 -0.749 . . . . 1.6 109.987 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.523 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -161.49 155.02 21.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.96 -1.088 . . . . 0.14 110.378 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.62 155.72 80.8 Favored Pre-proline 0 N--CA 1.506 2.361 0 N-CA-C 107.596 -1.261 . . . . 0.15 107.596 178.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -73.03 142.87 76.08 Favored 'Cis proline' 0 N--CA 1.495 1.615 0 CA-C-N 120.22 1.114 . . . . 0.16 112.759 -2.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 89.8 m -130.1 129.97 44.24 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.511 -0.922 . . . . 0.13 108.511 178.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.563 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.8 m-85 -106.94 130.32 54.62 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.2 109.741 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.404 HE22 ' HB1' ' A' ' 69' ' ' ALA . 71.7 mt-30 -122.07 139.88 53.19 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.162 -0.961 . . . . 0.29 109.256 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -105.82 137.76 43.15 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.496 0.665 . . . . 0.14 110.448 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.82 150.27 52.06 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.82 -0.807 . . . . 0.15 108.82 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -147.16 129.37 15.64 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.562 -1.273 . . . . 1.68 107.562 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.7 mttt 52.0 32.26 9.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.836 -1.165 . . . . 1.22 109.04 -178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.83 21.65 76.15 Favored Glycine 0 N--CA 1.483 1.811 0 N-CA-C 110.452 -1.059 . . . . 0.23 110.452 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -127.87 142.48 51.26 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.298 -1.119 . . . . 2.07 110.26 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -76.84 127.34 32.56 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.46 -0.775 . . . . 1.82 109.456 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -121.35 1.56 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.562 -0.711 . . . . 0.3 110.442 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.92 163.69 31.02 Favored Glycine 0 N--CA 1.5 2.903 0 C-N-CA 118.701 -1.714 . . . . 0.17 111.57 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.486 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.4 tp10 -166.7 149.97 6.88 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.53 -0.983 . . . . 1.93 109.178 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.486 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.6 p90 -168.76 157.72 8.56 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.084 -1.01 . . . . 0.14 109.794 177.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -126.76 164.51 21.18 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.602 -0.687 . . . . 0.12 109.736 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.47 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 116.37 145.26 8.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.849 -1.301 . . . . 0.12 109.849 179.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.433 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -78.77 68.04 4.65 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.552 -0.97 . . . . 0.18 109.524 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.477 ' ND2' ' OE1' ' A' ' 95' ' ' GLU . 0.7 OUTLIER -119.15 91.69 3.62 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 108.334 -0.988 . . . . 0.88 108.334 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.536 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -67.27 -30.98 71.01 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.636 -0.665 . . . . 1.06 111.55 -178.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . 0.477 ' OE1' ' ND2' ' A' ' 93' ' ' ASN . 55.2 mp0 -67.42 -30.12 69.78 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.809 -1.182 . . . . 1.61 109.144 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.35 -35.26 75.25 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.268 -0.895 . . . . 1.45 108.762 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.1 mt -59.56 -38.96 82.5 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.904 0.859 . . . . 0.19 108.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -62.83 -43.38 98.94 Favored 'General case' 0 C--N 1.294 -1.816 0 C-N-CA 119.997 -0.681 . . . . 2.1 111.043 -178.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -43.8 70.7 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.114 -0.991 . . . . 0.19 112.032 -178.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -63.18 -39.5 94.83 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.943 -1.098 . . . . 0.2 109.996 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.417 ' O ' ' N ' ' A' ' 105' ' ' VAL . 49.4 mt -62.89 -49.19 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 120.984 -1.073 . . . . 0.16 108.391 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.443 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.5 t-20 -59.86 -36.62 77.25 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.84 -1.17 . . . . 0.95 107.84 179.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -67.17 -39.54 86.47 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.62 -0.675 . . . . 2.21 109.718 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.588 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.4 mt -100.82 0.57 38.91 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.839 -1.163 . . . . 0.25 111.683 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 102' ' ' ASN . 7.9 p . . . . . 0 N--CA 1.497 1.892 0 O-C-N 120.191 -1.568 . . . . 1.08 109.395 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.491 1.61 0 CA-C-O 120.669 0.271 . . . . 1.31 110.331 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.523 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 31.2 mm -130.51 142.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 N-CA-C 109.728 -0.471 . . . . 0.15 109.728 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.4 m -97.69 129.55 44.74 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.635 -1.617 . . . . 0.19 106.635 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -79.53 139.86 37.42 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.894 -1.129 . . . . 0.2 111.307 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.433 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.0 m95 -74.42 -11.51 60.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.674 -0.641 . . . . 0.21 109.273 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.43 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.1 m120 . . . . . 0 N--CA 1.488 1.473 0 O-C-N 121.399 -0.813 . . . . 0.49 109.033 179.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 43.9 tptt . . . . . 0 N--CA 1.5 2.074 0 N-CA-C 108.546 -0.909 . . . . 1.67 108.546 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -96.45 124.01 40.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.201 -0.937 . . . . 0.31 108.653 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.2 mm -100.73 113.78 37.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 N-CA-C 108.364 -0.976 . . . . 0.19 108.364 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.74 -3.7 32.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.278 -0.889 . . . . 2.25 109.321 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -152.49 155.9 38.37 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.22 -0.925 . . . . 0.15 110.612 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -64.59 -31.84 73.23 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.349 -0.982 . . . . 1.65 108.349 178.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.7 m -55.64 -47.87 75.91 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.416 -0.913 . . . . 0.23 109.018 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.08 -30.24 69.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.427 -0.796 . . . . 0.17 109.177 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.512 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.6 t80 -59.69 -45.23 92.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.189 -0.944 . . . . 0.14 109.237 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -63.87 -41.41 97.76 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 108.89 -0.781 . . . . 1.31 108.89 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.98 -37.21 86.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.677 -0.639 . . . . 1.77 110.006 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.45 80.32 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.369 -0.832 . . . . 0.15 109.42 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.512 HD11 ' CE2' ' A' ' 11' ' ' PHE . 85.1 mt -60.21 -40.12 88.99 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.444 -0.947 . . . . 0.17 108.444 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.83 -34.77 74.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.625 -0.672 . . . . 1.07 109.925 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.7 85.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.283 -0.886 . . . . 0.18 109.91 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.47 -31.87 71.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.246 -0.909 . . . . 0.17 109.999 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.49 18.38 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.687 -1.365 . . . . 0.2 109.687 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -91.77 2.52 56.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -1.102 . . . . 1.07 110.374 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -76.02 149.16 37.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.98 -1.075 . . . . 1.5 109.593 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.666 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.84 159.57 8.81 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.487 -1.301 . . . . 0.47 107.487 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.666 ' H ' HD23 ' A' ' 22' ' ' LEU . 96.1 t -146.9 109.94 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 O-C-N 120.823 -1.173 . . . . 0.17 108.82 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.7 t -98.27 142.27 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 N-CA-C 107.971 -1.122 . . . . 0.14 107.971 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.96 121.0 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.455 -0.778 . . . . 0.13 109.488 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.552 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.9 t70 -98.67 119.74 37.92 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.395 -0.816 . . . . 1.05 110.404 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -96.18 21.67 8.61 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.456 -0.777 . . . . 0.73 109.743 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -57.29 145.01 33.47 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.978 -1.076 . . . . 0.3 109.945 -178.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.562 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.9 127.43 33.5 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.678 -1.23 . . . . 0.22 107.678 179.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -68.59 -31.7 71.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.827 -1.149 . . . . 0.3 108.822 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.562 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.6 p-90 -73.22 -20.81 60.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.066 -1.021 . . . . 0.26 110.838 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 21.6 t -81.88 122.64 28.0 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.834 -1.166 . . . . 0.26 108.54 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.491 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.42 -54.04 34.86 Favored Glycine 0 N--CA 1.489 2.175 0 C-N-CA 120.748 -0.739 . . . . 0.23 111.822 -178.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.2 Cg_endo -60.56 -30.0 89.71 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 CA-C-N 119.398 1.599 . . . . 0.31 112.533 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -77.39 -54.19 6.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.072 -1.017 . . . . 0.24 109.695 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -61.35 -38.15 85.91 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.305 -0.872 . . . . 1.59 109.673 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.44 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 35.5 ttm -59.88 -28.17 67.31 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.46 -0.775 . . . . 2.1 109.529 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 38' ' ' ILE . 66.4 mt -80.94 -4.41 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.847 -0.533 . . . . 0.49 110.735 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.546 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.2 ptmt -64.36 -26.07 1.79 Allowed Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 120.364 -1.46 . . . . 0.8 113.174 -178.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.546 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.5 Cg_exo -57.42 -40.29 82.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 122.468 1.917 . . . . 0.28 112.663 -177.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -67.9 -46.16 72.38 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 118.204 -1.398 . . . . 0.37 108.196 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -60.18 -53.9 52.23 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.125 -0.985 . . . . 0.16 109.884 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.0 t60 -68.09 -40.17 82.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.595 -0.691 . . . . 0.32 111.391 179.964 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.51 -39.16 92.62 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.855 -1.153 . . . . 0.22 110.643 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.86 -21.91 65.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.183 -0.948 . . . . 0.22 110.368 -178.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.3 m -53.51 -34.95 59.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.854 -1.154 . . . . 0.16 108.478 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 44.8 mp0 -88.75 -14.9 36.05 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.486 -0.759 . . . . 2.16 109.123 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.13 -37.79 37.71 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.708 -1.219 . . . . 1.78 107.708 178.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -123.13 68.87 0.99 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 106.861 -1.533 . . . . 0.25 106.861 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.8 p -63.38 -8.53 9.13 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.932 -0.766 . . . . 0.22 108.932 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -90.98 8.94 32.74 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.275 -0.891 . . . . 1.13 108.62 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.448 HG13 ' HB3' ' A' ' 22' ' ' LEU . 42.8 t -127.29 144.97 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.685 -1.228 . . . . 0.24 107.685 178.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -99.82 123.65 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.009 -1.057 . . . . 0.15 109.473 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.546 ' C ' HD12 ' A' ' 55' ' ' LEU . 44.3 m-85 -104.81 125.25 50.67 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.424 -0.798 . . . . 0.12 109.7 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.546 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.7 mp -110.0 142.7 41.03 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.121 -0.987 . . . . 0.22 109.196 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -109.95 131.7 54.82 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.908 -1.516 . . . . 1.13 106.908 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.0 t -128.28 137.76 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.325 -0.859 . . . . 0.15 110.6 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.0 t0 -100.17 119.0 37.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 1.05 108.905 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -67.96 -17.54 22.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 120.394 -1.441 . . . . 0.16 108.149 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.513 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.3 m-20 -90.01 -42.72 10.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 1.08 111.458 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -97.66 -22.15 16.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.651 -1.28 . . . . 1.07 109.276 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -115.96 38.39 3.35 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.146 -1.427 . . . . 0.14 107.146 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.65 HE21 ' H ' ' A' ' 64' ' ' ASP . 1.8 pm0 -60.34 -20.49 59.54 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.814 -0.63 . . . . 1.47 109.65 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.65 ' H ' HE21 ' A' ' 63' ' ' GLN . 1.5 p30 -63.76 -37.92 89.19 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.959 -1.088 . . . . 1.05 108.933 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.624 HG23 ' OD1' ' A' ' 64' ' ' ASP . 14.8 t -74.38 -43.55 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.327 -0.858 . . . . 0.35 109.532 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.26 -39.64 78.31 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.491 -0.755 . . . . 0.26 111.005 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.9 p -62.64 -35.68 80.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.915 -1.116 . . . . 0.24 109.166 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.6 -38.45 91.16 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.489 -0.757 . . . . 2.06 109.569 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.72 -0.19 56.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.282 -0.886 . . . . 0.23 111.285 -178.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 54.87 50.31 15.91 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.866 -1.146 . . . . 2.02 110.42 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.9 t -65.66 132.24 31.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 120.941 -1.1 . . . . 0.16 109.114 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -103.83 -11.94 17.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.601 -0.687 . . . . 1.6 110.693 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.504 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -163.9 155.27 16.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.81 -1.181 . . . . 0.14 110.348 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -126.74 155.92 74.41 Favored Pre-proline 0 N--CA 1.498 1.959 0 N-CA-C 107.6 -1.259 . . . . 0.15 107.6 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -75.99 143.91 78.14 Favored 'Cis proline' 0 N--CA 1.487 1.098 0 C-N-CA 123.681 -1.383 . . . . 0.16 112.541 -1.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.82 133.79 48.13 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.517 -0.92 . . . . 0.13 108.517 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.552 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -113.33 131.47 55.95 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.538 -0.912 . . . . 0.2 108.538 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -122.54 141.62 51.48 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.273 -0.892 . . . . 0.29 108.684 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -107.8 132.64 53.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.697 -0.627 . . . . 0.14 110.582 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -125.28 147.39 49.13 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.368 0.604 . . . . 0.15 109.499 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -148.36 124.33 10.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.305 -0.872 . . . . 1.68 109.025 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.8 mttm 59.63 29.08 18.63 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.715 -1.217 . . . . 1.22 107.715 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.24 20.58 77.1 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.593 -1.403 . . . . 0.23 109.593 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -124.21 137.02 54.57 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.483 -1.01 . . . . 2.07 110.965 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.64 125.42 29.34 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.1 -1.0 . . . . 1.82 108.851 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 m -124.62 13.89 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.724 -0.61 . . . . 0.3 110.703 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.45 157.55 18.63 Favored Glycine 0 N--CA 1.499 2.88 0 C-N-CA 118.969 -1.586 . . . . 0.17 111.066 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.482 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.92 148.44 7.33 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.553 -0.906 . . . . 1.93 108.553 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.482 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 3.5 p90 -168.23 157.59 9.43 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.241 -0.912 . . . . 0.14 109.749 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -126.52 159.88 32.16 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.529 -0.732 . . . . 0.12 110.041 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.46 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.95 143.7 6.62 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.805 -1.318 . . . . 0.12 109.805 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.499 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.91 64.76 3.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.19 -1.182 . . . . 0.18 109.81 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.42 94.25 4.48 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.015 -1.106 . . . . 0.88 108.015 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -31.44 71.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.04 -1.037 . . . . 1.06 111.129 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -65.3 -29.77 70.56 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.905 -1.122 . . . . 1.61 109.351 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -60.42 -34.31 73.78 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.916 -0.772 . . . . 1.45 108.916 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.67 -38.81 82.5 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.051 0.929 . . . . 0.19 108.74 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.2 -43.72 98.2 Favored 'General case' 0 C--N 1.292 -1.918 0 C-N-CA 119.785 -0.766 . . . . 2.1 110.909 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.78 -44.0 74.56 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 0.19 111.861 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.4 m -64.79 -40.06 94.62 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.741 -1.224 . . . . 0.2 109.64 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.6 mt -60.79 -49.58 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.339 -0.986 . . . . 0.16 108.339 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.483 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.6 t-20 -60.35 -35.18 75.08 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.99 0.9 . . . . 0.95 108.581 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.81 -39.58 87.75 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.864 -0.523 . . . . 2.21 109.6 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.662 ' HB2' HD11 ' A' ' 22' ' ' LEU . 82.5 mt -99.63 -2.86 34.47 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.197 -0.94 . . . . 0.25 111.631 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.483 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.496 1.842 0 O-C-N 120.545 -1.347 . . . . 1.08 109.515 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 45.3 mmtm . . . . . 0 N--CA 1.49 1.572 0 N-CA-C 108.815 -0.809 . . . . 1.31 108.815 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.504 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 28.5 mm -131.5 140.0 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 O-C-N 121.864 -0.522 . . . . 0.15 109.732 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.0 m -96.4 128.44 43.33 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.156 -1.424 . . . . 0.19 107.156 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 55.2 m -77.61 141.6 39.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.723 -1.235 . . . . 0.2 110.751 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.453 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.7 m95 -76.94 -11.83 59.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.439 -0.788 . . . . 0.21 108.912 178.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 m120 . . . . . 0 C--N 1.304 -1.398 0 N-CA-C 108.586 -0.894 . . . . 0.49 108.586 179.514 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.0 tptt . . . . . 0 N--CA 1.499 1.983 0 N-CA-C 108.874 -0.787 . . . . 1.67 108.874 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -97.86 121.88 40.31 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.235 -1.024 . . . . 0.31 108.235 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.0 mm -99.99 112.89 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.19 108.743 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.04 -0.03 47.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 2.25 109.903 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -153.53 156.39 37.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.707 -1.246 . . . . 0.15 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -65.06 -33.0 74.99 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.318 -0.993 . . . . 1.65 108.318 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 90.0 m -56.14 -48.05 76.99 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.871 -0.788 . . . . 0.23 108.871 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.67 -29.69 66.08 Favored 'General case' 0 C--N 1.295 -1.763 0 O-C-N 121.545 -0.722 . . . . 0.17 109.089 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.9 t80 -59.66 -44.09 93.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.188 -0.945 . . . . 0.14 109.164 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -65.92 -43.93 86.65 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.834 -0.802 . . . . 1.31 108.834 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -63.59 -36.31 83.38 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.465 0.65 . . . . 1.77 110.068 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.97 -43.84 78.08 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.349 -0.845 . . . . 0.15 109.439 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.535 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.6 mt -60.88 -40.14 91.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.441 -0.787 . . . . 0.17 109.321 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -69.48 -32.61 71.61 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.426 -0.796 . . . . 1.07 110.448 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.68 83.04 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.18 109.355 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.82 -36.11 80.18 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.511 -0.743 . . . . 0.17 109.625 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.48 -123.27 16.29 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.976 -1.249 . . . . 0.2 109.976 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -91.15 3.75 53.98 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.195 -1.18 . . . . 1.07 110.224 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -77.14 149.18 35.65 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.994 -1.066 . . . . 1.5 109.768 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.694 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.3 153.72 21.88 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.834 -1.173 . . . . 0.47 107.834 -179.798 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.694 ' H ' HD23 ' A' ' 22' ' ' LEU . 57.3 t -143.97 120.73 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 N-CA-C 107.995 -1.113 . . . . 0.17 107.995 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -108.03 140.08 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.456 -0.942 . . . . 0.14 108.456 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -123.25 119.9 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.327 -0.858 . . . . 0.13 109.462 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.568 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 25.6 t70 -97.37 108.96 21.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.496 -0.753 . . . . 1.05 110.8 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.98 103.03 15.73 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.268 -1.753 . . . . 0.73 106.268 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.4 m -130.07 150.05 51.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.016 -0.735 . . . . 0.3 109.016 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.625 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.61 120.97 29.46 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.455 -1.313 . . . . 0.22 107.455 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -65.73 -32.21 73.63 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 118.541 -1.264 . . . . 0.3 108.039 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.625 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.3 p-90 -70.73 -23.77 62.51 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.32 -0.863 . . . . 0.26 111.063 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -84.43 115.13 22.38 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.827 -1.171 . . . . 0.26 108.751 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.454 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.72 -50.75 64.3 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 120.819 -0.705 . . . . 0.23 111.787 -178.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.2 Cg_exo -51.97 -36.18 63.55 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 CA-C-N 118.826 1.313 . . . . 0.31 112.866 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.5 -47.83 21.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.128 -0.982 . . . . 0.24 109.623 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.28 -35.68 76.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 1.59 109.097 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.54 ' SD ' ' O ' ' A' ' 37' ' ' MET . 11.6 tmm? -59.64 -29.36 67.98 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.516 -0.74 . . . . 2.1 110.06 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.539 HG22 ' O ' ' A' ' 38' ' ' ILE . 71.0 mt -82.71 -1.32 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.539 -0.726 . . . . 0.49 110.822 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.538 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.96 -30.12 6.43 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 120.535 -1.353 . . . . 0.8 113.976 -178.832 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.38 -40.6 66.08 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 CA-C-N 121.618 1.614 . . . . 0.28 113.266 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -68.8 -49.66 56.73 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 118.365 -1.334 . . . . 0.37 109.303 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.33 -51.08 71.06 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 121.761 0.791 . . . . 0.16 109.34 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.7 t60 -66.73 -40.96 88.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.621 -0.674 . . . . 0.32 110.724 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.422 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 72.3 m -63.39 -39.02 93.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.903 -1.123 . . . . 0.22 110.498 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.34 -23.08 66.57 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 0.22 111.366 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.4 m -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.788 -1.195 . . . . 0.16 108.364 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -88.94 -15.56 33.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.273 -0.892 . . . . 2.16 109.355 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HD3' ' CE2' ' A' ' 49' ' ' TYR . 13.2 tmtt? -79.26 -33.81 43.17 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.151 -1.425 . . . . 1.78 107.151 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.411 ' CE2' ' HD3' ' A' ' 48' ' ' LYS . 71.3 m-85 -122.16 64.43 0.93 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 106.776 -1.564 . . . . 0.25 106.776 177.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.5 p -61.86 -9.29 6.4 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.74 -0.837 . . . . 0.22 108.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -91.1 8.63 34.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.506 -0.746 . . . . 1.13 109.207 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.0 t -128.24 152.72 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 N-CA-C 108.225 -1.028 . . . . 0.24 108.225 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -102.73 122.12 54.69 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.148 -0.97 . . . . 0.15 110.132 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.589 ' C ' HD12 ' A' ' 55' ' ' LEU . 54.0 m-85 -105.49 130.05 53.65 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.238 -0.914 . . . . 0.12 109.868 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.589 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.4 mp -114.29 143.14 45.36 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.307 -0.871 . . . . 0.22 109.495 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -113.66 131.08 56.28 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 106.954 -1.499 . . . . 1.13 106.954 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.4 t -128.43 136.46 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 O-C-N 121.215 -0.928 . . . . 0.15 111.344 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.4 t0 -99.49 120.01 38.94 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.932 -0.766 . . . . 1.05 108.932 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.7 m -68.25 -16.7 21.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 O-C-N 120.523 -1.361 . . . . 0.16 108.471 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.409 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.6 m-20 -94.47 -40.76 9.72 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.426 -0.796 . . . . 1.08 111.448 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.5 m-20 -96.84 -16.79 20.59 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.796 -1.19 . . . . 1.07 108.62 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.61 40.67 3.67 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.489 -1.3 . . . . 0.14 107.489 179.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.09 -20.31 57.51 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.879 -0.513 . . . . 1.47 110.206 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.644 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.7 p30 -65.56 -38.65 90.17 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.683 -1.26 . . . . 1.05 109.176 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.644 HG23 ' OD1' ' A' ' 64' ' ' ASP . 20.1 t -72.76 -42.57 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.199 -0.938 . . . . 0.35 109.459 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.71 -41.95 71.25 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.484 -0.76 . . . . 0.26 110.999 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.7 p -60.14 -36.08 76.72 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.869 -1.144 . . . . 0.24 108.533 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -64.41 -39.28 93.54 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.475 -0.766 . . . . 2.06 109.492 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.56 0.45 54.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.25 -0.906 . . . . 0.23 111.019 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 54.14 50.07 17.33 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.917 -1.115 . . . . 2.02 110.059 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -65.58 131.69 31.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.787 -1.196 . . . . 0.16 109.043 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -103.71 -14.36 16.13 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.717 -0.614 . . . . 1.6 109.937 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.461 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.6 152.33 15.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.938 -1.101 . . . . 0.14 110.769 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.407 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.4 p -127.49 154.4 77.44 Favored Pre-proline 0 N--CA 1.503 2.176 0 N-CA-C 107.736 -1.209 . . . . 0.15 107.736 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -76.22 141.19 69.57 Favored 'Cis proline' 0 N--CA 1.495 1.59 0 C-N-CA 124.147 -1.189 . . . . 0.16 112.991 -1.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.2 m -126.72 139.2 53.32 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.498 -0.927 . . . . 0.13 108.498 177.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.568 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.8 m-85 -112.61 131.8 55.45 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.349 -0.982 . . . . 0.2 108.349 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.98 139.9 53.59 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.432 -0.951 . . . . 0.29 108.432 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -107.68 129.6 55.0 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.542 0.687 . . . . 0.14 110.034 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -122.58 143.27 49.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.753 -0.832 . . . . 0.15 108.753 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -146.28 130.61 17.61 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.426 -1.694 . . . . 1.68 106.426 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.2 mttt 58.17 27.75 15.52 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 108.449 -0.945 . . . . 1.22 108.449 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.3 17.26 80.1 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.893 -1.283 . . . . 0.23 109.893 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -123.33 138.48 54.6 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.449 -1.03 . . . . 2.07 111.107 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -79.58 124.44 28.53 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.352 -0.842 . . . . 1.82 109.347 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.2 m -121.53 6.81 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.529 -0.732 . . . . 0.3 110.648 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.34 155.56 15.31 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 118.666 -1.731 . . . . 0.17 111.321 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -164.25 149.89 10.61 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.812 -0.816 . . . . 1.93 109.546 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.407 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 17.8 p90 -163.01 161.81 25.65 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.92 -1.112 . . . . 0.14 109.151 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -127.0 162.38 26.14 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.485 0.66 . . . . 0.12 110.276 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.494 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 118.27 141.66 6.78 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.465 -1.454 . . . . 0.12 109.465 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.01 64.88 1.97 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.34 -1.094 . . . . 0.18 109.795 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.47 95.9 5.17 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.558 -0.904 . . . . 0.88 108.558 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -34.1 73.15 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.248 -0.908 . . . . 1.06 111.212 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.24 -30.1 70.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.806 -1.184 . . . . 1.61 108.783 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -61.98 -34.43 76.14 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.746 -0.596 . . . . 1.45 109.404 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.417 HD21 ' CD1' ' A' ' 77' ' ' PHE . 50.8 mt -59.87 -39.93 86.93 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.13 0.967 . . . . 0.19 108.888 179.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -61.65 -43.64 98.48 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.581 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.29 -44.09 76.25 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.282 -0.886 . . . . 0.19 111.629 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.4 -40.02 92.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.733 -1.229 . . . . 0.2 109.659 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.6 mt -60.94 -49.48 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.206 -1.035 . . . . 0.16 108.206 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.465 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.5 t-20 -60.12 -34.78 73.98 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.48 -0.933 . . . . 0.95 108.48 179.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -67.91 -40.05 83.48 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.688 -0.632 . . . . 2.21 110.325 -178.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.643 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.9 mt -98.77 -3.68 35.09 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.148 -0.97 . . . . 0.25 111.117 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.492 1.631 0 O-C-N 120.548 -1.345 . . . . 1.08 109.076 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.4 mmtt . . . . . 0 N--CA 1.488 1.433 0 N-CA-C 109.416 -0.587 . . . . 1.31 109.416 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.494 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.7 mm -129.17 140.07 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.622 -0.674 . . . . 0.15 109.967 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 63.3 m -96.75 124.35 40.71 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.163 -1.421 . . . . 0.19 107.163 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -77.61 141.57 39.41 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.845 -1.159 . . . . 0.2 110.908 -178.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.407 ' NE1' HG23 ' A' ' 74' ' ' THR . 20.2 m95 -76.56 -10.01 59.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.005 -1.059 . . . . 0.21 108.508 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--N 1.304 -1.383 0 N-CA-C 108.577 -0.897 . . . . 0.49 108.577 179.847 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.8 tptt . . . . . 0 N--CA 1.497 1.914 0 N-CA-C 108.269 -1.011 . . . . 1.67 108.269 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -98.01 123.7 42.14 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.331 -0.989 . . . . 0.31 108.331 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.0 mm -101.56 112.79 35.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.186 -0.946 . . . . 0.19 108.508 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.444 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 50.4 mp0 -95.87 -1.26 49.78 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.313 -0.867 . . . . 2.25 109.392 -179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -153.98 154.8 34.41 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.947 -1.096 . . . . 0.15 111.439 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.412 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.9 ttpp -63.38 -31.16 72.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.98 -1.119 . . . . 1.65 107.98 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.8 m -59.05 -46.65 87.7 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.934 -0.765 . . . . 0.23 108.934 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 -30.02 66.4 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.288 -0.883 . . . . 0.17 108.692 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.58 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.6 t80 -59.45 -43.83 93.08 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.119 -0.988 . . . . 0.14 109.321 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -63.68 -41.98 98.09 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 119.634 -0.827 . . . . 1.31 108.796 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -64.94 -39.87 94.17 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.666 -0.646 . . . . 1.77 110.483 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -41.24 94.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.308 -0.87 . . . . 0.15 108.966 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.58 HD11 ' CE2' ' A' ' 11' ' ' PHE . 39.6 mt -61.23 -40.17 93.01 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.112 -0.993 . . . . 0.17 108.734 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.28 -34.55 72.91 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.965 -0.694 . . . . 1.07 109.698 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.03 80.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.362 -0.836 . . . . 0.18 110.298 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.23 70.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.069 -1.02 . . . . 0.17 109.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.81 -124.57 21.07 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.144 -1.582 . . . . 0.2 109.144 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -91.97 0.46 57.47 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -1.085 . . . . 1.07 110.336 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -75.72 149.89 37.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.996 -1.065 . . . . 1.5 109.345 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 22' ' ' LEU . 11.1 mt -55.81 160.58 2.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.019 -1.051 . . . . 0.47 110.213 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.1 t -148.62 108.35 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 107.995 -1.113 . . . . 0.17 107.995 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.3 t -100.95 140.8 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 107.606 -1.257 . . . . 0.14 107.606 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -124.63 124.5 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.186 -0.946 . . . . 0.13 109.748 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -101.09 116.96 34.05 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.431 -0.793 . . . . 1.05 110.022 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -91.95 22.53 4.22 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.73 110.265 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -54.52 144.42 21.38 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.666 -1.271 . . . . 0.3 110.667 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.693 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -80.99 127.97 33.17 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.084 -1.45 . . . . 0.22 107.084 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -67.94 -31.32 70.99 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.832 -1.147 . . . . 0.3 108.527 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.693 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 69.7 p-90 -76.53 -13.53 60.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.342 -0.849 . . . . 0.26 111.467 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.3 t -87.98 114.27 24.44 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.679 -1.263 . . . . 0.26 108.592 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.25 -51.94 54.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.647 -0.981 . . . . 0.23 110.647 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 32.9 Cg_exo -50.44 -38.04 52.65 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 CA-C-N 118.463 1.132 . . . . 0.31 112.183 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.99 -43.74 23.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.24 109.66 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -59.96 -32.13 70.53 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.986 -1.071 . . . . 1.59 108.819 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 54.5 ttm -60.41 -29.28 68.87 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 2.1 109.828 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.429 HD11 ' HB1' ' A' ' 92' ' ' ALA . 17.1 mt -80.29 -4.21 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.934 -0.479 . . . . 0.49 110.997 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.69 -30.93 7.11 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 119.823 -1.798 . . . . 0.8 113.724 -177.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.3 Cg_exo -59.5 -36.42 93.33 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 CA-C-N 121.586 1.602 . . . . 0.28 112.0 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -72.41 -51.63 19.52 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 118.686 -1.206 . . . . 0.37 108.874 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -59.61 -48.28 82.27 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.892 -0.781 . . . . 0.16 108.892 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -68.18 -42.46 79.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.298 -0.876 . . . . 0.32 110.812 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.3 m -64.52 -37.09 86.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.927 -1.108 . . . . 0.22 110.771 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.8 -22.78 66.87 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.125 -0.984 . . . . 0.22 110.525 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -53.57 -37.14 62.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.766 -1.209 . . . . 0.16 107.903 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -87.85 -15.34 37.05 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.556 -0.715 . . . . 2.16 109.501 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -76.69 -38.26 54.73 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.254 -1.387 . . . . 1.78 107.254 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -123.66 69.37 1.04 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.183 -1.414 . . . . 0.25 107.183 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.3 p -64.18 -8.98 14.17 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.012 -0.736 . . . . 0.22 109.012 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -89.07 8.54 29.3 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.621 -0.881 . . . . 1.13 108.621 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.36 146.46 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.059 -1.089 . . . . 0.24 108.059 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.1 mm -99.79 119.75 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 120.997 -1.064 . . . . 0.15 109.828 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.576 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.3 m-85 -101.15 127.85 47.52 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.273 -0.892 . . . . 0.12 109.98 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.7 mp -110.75 143.0 41.95 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.229 -0.919 . . . . 0.22 110.13 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -113.53 129.66 56.51 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 106.973 -1.492 . . . . 1.13 106.973 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.5 t -127.97 132.0 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.152 -0.968 . . . . 0.15 110.914 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 52.2 t0 -93.74 119.88 33.29 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.815 -0.809 . . . . 1.05 108.815 179.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.19 -17.33 22.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 120.672 -1.267 . . . . 0.16 107.797 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.503 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.18 -43.97 9.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 1.08 111.527 -178.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -94.41 -14.99 24.7 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.649 -1.282 . . . . 1.07 108.573 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.02 37.62 4.37 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.966 -1.124 . . . . 0.14 107.966 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.57 -18.14 38.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.8 -0.563 . . . . 1.47 110.668 -178.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 1.3 p30 -66.36 -43.08 87.02 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.838 -1.164 . . . . 1.05 108.719 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.2 t -68.72 -44.62 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.469 -0.769 . . . . 0.35 110.056 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.25 -39.08 75.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.426 -0.796 . . . . 0.26 110.663 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -62.62 -32.79 73.87 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.942 -1.099 . . . . 0.24 109.154 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.05 -39.86 95.02 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.494 -0.754 . . . . 2.06 109.617 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.33 2.03 51.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -0.932 . . . . 0.23 110.476 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 53.14 51.55 15.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.322 -0.861 . . . . 2.02 108.788 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.5 t -63.97 131.14 29.55 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 C-N-CA 118.517 -1.273 . . . . 0.16 108.391 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -103.77 -11.38 17.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.679 -0.638 . . . . 1.6 110.707 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.7 154.87 18.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.709 -1.245 . . . . 0.14 111.167 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.494 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.4 p -126.34 154.53 74.77 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.359 -0.978 . . . . 0.15 108.359 178.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.35 143.69 75.54 Favored 'Cis proline' 0 N--CA 1.494 1.518 0 C-N-CA 123.829 -1.321 . . . . 0.16 112.615 -2.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 86.0 m -129.66 131.19 46.32 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.556 0.693 . . . . 0.13 109.305 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -108.59 132.76 53.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.6 -0.687 . . . . 0.2 109.221 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -122.72 141.07 52.18 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.506 -0.924 . . . . 0.29 108.506 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -108.51 133.9 52.03 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.741 -0.599 . . . . 0.14 110.167 -179.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -124.56 147.26 48.54 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.502 0.668 . . . . 0.15 109.837 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -144.99 128.58 17.1 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.87 -1.159 . . . . 1.68 107.87 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 49.69 38.78 16.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.116 -0.99 . . . . 1.22 108.335 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.73 24.29 76.38 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.796 -1.192 . . . . 0.23 110.169 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -128.37 135.12 49.11 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.333 -1.098 . . . . 2.07 110.339 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -79.46 127.38 32.05 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.035 -1.04 . . . . 1.82 109.312 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.9 m -124.19 5.59 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.71 -0.619 . . . . 0.3 110.692 -179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.82 154.22 13.89 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 118.465 -1.826 . . . . 0.17 111.476 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.7 tm-20 -164.88 149.71 9.39 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.788 -0.83 . . . . 1.93 109.305 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.439 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 15.1 p90 -163.18 160.97 24.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.192 -1.003 . . . . 0.14 109.524 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.73 159.99 30.9 Favored 'General case' 0 N--CA 1.5 2.053 0 CA-C-O 121.388 0.614 . . . . 0.12 109.71 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.463 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.88 142.14 6.09 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 108.933 -1.667 . . . . 0.12 108.933 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.429 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.09 66.01 4.42 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.217 -1.167 . . . . 0.18 109.94 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.6 t-20 -119.64 99.89 6.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.351 -0.843 . . . . 0.88 109.306 178.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.413 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.47 -33.51 74.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.341 -0.849 . . . . 1.06 111.672 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.22 -27.13 67.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.438 -1.414 . . . . 1.61 109.376 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 22.5 ttmt -61.13 -37.75 83.93 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.144 -1.058 . . . . 1.45 108.144 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.5 mt -58.63 -39.6 80.99 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 122.056 0.931 . . . . 0.19 108.5 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -61.53 -43.22 99.25 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.21 -0.596 . . . . 2.1 111.005 -178.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.53 -43.99 71.9 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.094 -1.004 . . . . 0.19 112.08 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.99 -39.23 93.16 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.798 -1.189 . . . . 0.2 110.172 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.98 -49.57 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.097 -1.002 . . . . 0.16 108.377 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.8 t-20 -60.91 -35.76 77.52 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.589 -0.893 . . . . 0.95 108.589 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.5 tm-20 -68.25 -39.1 82.35 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.695 -0.628 . . . . 2.21 110.166 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.91 -6.5 28.77 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.002 -1.061 . . . . 0.25 111.534 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' ' 105' ' ' VAL . 7.9 p . . . . . 0 N--CA 1.501 2.101 0 O-C-N 120.441 -1.412 . . . . 1.08 109.657 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 67.2 mmtt . . . . . 0 N--CA 1.488 1.441 0 N-CA-C 108.765 -0.828 . . . . 1.31 108.765 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.463 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.4 mm -130.07 140.32 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.794 -0.566 . . . . 0.15 109.571 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -99.83 129.83 45.97 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 106.759 -1.571 . . . . 0.19 106.759 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.1 m -81.46 138.4 35.52 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.535 -1.353 . . . . 0.2 111.321 -178.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.494 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.2 m95 -72.11 -9.79 58.9 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.064 -1.022 . . . . 0.21 109.572 178.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 m120 . . . . . 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.49 109.272 -179.907 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 80.2 tttt . . . . . 0 N--CA 1.495 1.802 0 N-CA-C 108.885 -0.783 . . . . 1.67 108.885 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -94.3 124.12 38.12 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.359 -0.978 . . . . 0.31 108.359 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -100.16 112.85 33.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 108.478 -0.934 . . . . 0.19 108.478 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.454 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -97.39 -0.26 46.61 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.063 -1.023 . . . . 2.25 109.652 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -155.16 159.15 39.94 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.993 -1.067 . . . . 0.15 111.216 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -63.5 -32.34 73.76 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.073 -1.084 . . . . 1.65 108.073 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.432 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 88.1 m -57.76 -48.35 79.9 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.665 -0.814 . . . . 0.23 108.813 -179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -30.86 69.45 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.259 -0.901 . . . . 0.17 108.715 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.1 t80 -59.33 -43.87 92.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.149 -0.969 . . . . 0.14 109.06 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -66.35 -42.99 87.27 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 120.046 -0.662 . . . . 1.31 109.449 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -65.12 -39.94 93.79 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.69 -0.631 . . . . 1.77 110.328 179.629 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.73 88.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.081 -1.012 . . . . 0.15 109.446 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.539 HD11 ' CE2' ' A' ' 11' ' ' PHE . 63.8 mt -60.71 -39.94 90.42 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.162 -1.051 . . . . 0.17 108.162 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -69.84 -36.96 75.99 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.674 -0.641 . . . . 1.07 110.205 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.76 -37.48 82.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.51 -0.744 . . . . 0.18 109.926 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.07 72.93 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.871 . . . . 0.17 109.649 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -125.87 24.67 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 110.015 -1.234 . . . . 0.2 110.015 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -92.02 5.9 48.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.107 -1.231 . . . . 1.07 110.203 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -76.39 149.36 36.93 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.838 -1.164 . . . . 1.5 109.472 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.676 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.05 155.53 16.78 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.523 -1.288 . . . . 0.47 107.523 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.655 ' H ' HD23 ' A' ' 22' ' ' LEU . 64.7 t -143.22 111.54 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 O-C-N 120.919 -1.113 . . . . 0.17 109.059 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.0 t -100.65 141.88 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 107.91 -1.145 . . . . 0.14 107.91 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.06 124.31 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.341 -0.85 . . . . 0.13 109.443 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.5 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.637 -0.664 . . . . 1.05 110.144 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -95.91 23.17 6.58 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.348 -0.845 . . . . 0.73 109.95 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.415 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.5 m -59.02 145.25 42.58 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.844 -1.16 . . . . 0.3 110.385 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.582 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.05 126.81 33.42 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.547 -1.279 . . . . 0.22 107.547 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -68.27 -28.31 67.09 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 118.848 -1.141 . . . . 0.3 108.781 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.582 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.8 p-90 -77.42 -19.22 56.4 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.079 -1.013 . . . . 0.26 110.072 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 34.2 t -83.84 122.45 28.71 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.167 -1.049 . . . . 0.26 108.167 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.49 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.6 -54.08 34.11 Favored Glycine 0 N--CA 1.488 2.113 0 C-N-CA 120.728 -0.749 . . . . 0.23 111.977 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.3 Cg_endo -59.53 -31.04 93.93 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 CA-C-N 119.588 1.694 . . . . 0.31 112.404 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -76.69 -55.48 5.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.036 -1.04 . . . . 0.24 109.805 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -60.16 -38.43 83.15 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.942 -1.099 . . . . 1.59 110.25 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.33 -28.79 67.14 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.088 -1.008 . . . . 2.1 109.677 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.8 mt -83.36 -3.86 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.751 -0.593 . . . . 0.49 111.312 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.4 ptmt -66.67 -29.83 3.0 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 120.262 -1.524 . . . . 0.8 113.468 -177.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -54.74 -39.83 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.759 1.664 . . . . 0.28 112.409 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.434 ' CD2' ' HG3' ' A' ' 94' ' ' LYS . 32.4 m-85 -68.74 -44.05 74.61 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 118.187 -1.405 . . . . 0.37 108.134 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -60.34 -54.18 48.77 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.33 -0.856 . . . . 0.16 109.533 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.3 t60 -66.98 -39.92 87.29 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.82 -0.55 . . . . 0.32 110.554 -179.593 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 75.7 m -61.47 -37.79 84.91 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.87 -1.144 . . . . 0.22 110.286 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.3 mt -60.99 -23.6 65.49 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.334 -0.854 . . . . 0.22 110.298 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -54.79 -38.94 67.91 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.069 -1.02 . . . . 0.16 108.915 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.8 mp0 -87.87 -13.51 41.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 2.16 109.733 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -80.34 -37.49 32.42 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 105.76 -1.941 . . . . 1.78 105.76 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -123.1 66.75 0.98 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.199 -1.408 . . . . 0.25 107.199 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.3 p -62.33 -8.32 5.73 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.952 -0.759 . . . . 0.22 108.952 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -91.03 9.72 29.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.737 -0.838 . . . . 1.13 108.737 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.469 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.5 t -129.3 147.01 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 N-CA-C 108.169 -1.048 . . . . 0.24 108.169 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.8 120.1 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 120.961 -1.087 . . . . 0.15 110.165 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.477 ' C ' HD12 ' A' ' 55' ' ' LEU . 29.3 m-85 -102.28 127.84 49.08 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.985 -1.072 . . . . 0.12 109.348 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.477 HD12 ' C ' ' A' ' 54' ' ' PHE . 1.9 mp -110.02 140.3 44.19 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.245 -0.909 . . . . 0.22 109.389 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -110.4 129.52 55.74 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.69 -1.596 . . . . 1.13 106.69 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.67 129.87 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 121.555 0.693 . . . . 0.15 110.252 -178.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 55.7 t0 -93.24 119.58 32.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.333 -0.988 . . . . 1.05 108.333 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -67.29 -20.46 26.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 C-N-CA 118.301 -1.36 . . . . 0.16 108.186 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.541 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.39 -42.12 10.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.433 -0.792 . . . . 1.08 111.696 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.441 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 22.0 m-20 -96.18 -13.86 23.2 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.688 -1.257 . . . . 1.07 108.412 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -126.06 40.05 3.81 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.703 -1.221 . . . . 0.14 107.703 179.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -59.86 -24.81 64.53 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.841 -0.537 . . . . 1.47 109.969 -178.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.608 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -65.52 -39.36 91.71 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.79 -1.194 . . . . 1.05 109.497 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.608 HG23 ' OD1' ' A' ' 64' ' ' ASP . 15.2 t -69.92 -44.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.133 -0.979 . . . . 0.35 109.669 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -36.52 66.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.681 -0.637 . . . . 0.26 110.847 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.8 p -60.55 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.24 109.573 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.3 -37.08 85.85 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.292 -0.88 . . . . 2.06 109.537 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.459 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.13 -0.15 53.59 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 0.23 111.04 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.2 mp0 54.38 49.41 18.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.984 -1.073 . . . . 2.02 109.845 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.85 134.35 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 120.833 -1.167 . . . . 0.16 108.763 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -106.43 -12.48 15.63 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.527 -0.733 . . . . 1.6 110.474 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.487 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -161.26 153.37 19.86 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.836 -1.165 . . . . 0.14 110.562 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -125.2 155.65 70.88 Favored Pre-proline 0 N--CA 1.499 2.016 0 N-CA-C 107.861 -1.163 . . . . 0.15 107.861 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -76.35 145.09 81.22 Favored 'Cis proline' 0 N--CA 1.491 1.341 0 C-N-CA 123.724 -1.365 . . . . 0.16 112.514 -2.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.7 m -129.45 132.2 46.91 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 108.735 -0.839 . . . . 0.13 108.735 178.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.729 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.0 m-85 -110.16 130.76 55.49 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 109.109 -0.7 . . . . 0.2 109.109 -179.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.459 HE22 ' HB1' ' A' ' 69' ' ' ALA . 72.2 mt-30 -122.82 139.34 54.12 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.739 -0.838 . . . . 0.29 108.739 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -106.83 132.06 53.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.356 0.598 . . . . 0.14 110.197 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -125.94 147.75 49.42 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.181 -0.674 . . . . 0.15 109.181 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -147.18 125.54 12.32 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.483 -1.303 . . . . 1.68 107.483 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.1 mttt 59.58 28.22 17.58 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.195 -1.409 . . . . 1.22 107.195 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.455 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 76.34 16.24 80.86 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.996 -1.242 . . . . 0.23 109.996 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.455 HE21 ' C ' ' A' ' 83' ' ' GLY . 7.0 mm-40 -115.57 132.94 56.47 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.472 -1.016 . . . . 2.07 110.467 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -77.14 124.22 27.5 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 107.896 -1.15 . . . . 1.82 107.896 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.8 m -123.52 11.88 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.696 -0.627 . . . . 0.3 110.06 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.23 156.03 15.08 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 118.909 -1.615 . . . . 0.17 111.251 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -166.4 148.0 6.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.886 -0.773 . . . . 1.93 109.223 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.573 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 7.1 p90 -164.47 159.04 18.99 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 119.828 -0.749 . . . . 0.14 109.523 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.67 161.39 28.19 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.558 0.694 . . . . 0.12 110.022 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.439 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.98 142.1 5.93 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.519 -1.433 . . . . 0.12 109.519 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.566 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.26 65.06 2.78 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -1.094 . . . . 0.18 109.721 -179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -120.04 90.82 3.4 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.398 -0.964 . . . . 0.88 108.398 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.492 ' H ' ' CD ' ' A' ' 94' ' ' LYS . 0.2 OUTLIER -64.47 -35.13 79.95 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.068 -1.02 . . . . 1.06 111.546 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -62.04 -30.06 70.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.798 -1.189 . . . . 1.61 109.969 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.573 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 58.3 tttm -61.46 -32.91 72.91 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.669 0.747 . . . . 1.45 109.314 -179.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.729 HD21 ' CD1' ' A' ' 77' ' ' PHE . 47.0 mt -59.62 -39.68 85.04 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.215 -1.031 . . . . 0.19 108.215 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.47 -41.36 97.12 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 120.073 -0.651 . . . . 2.1 110.547 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.82 -43.45 75.54 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.087 -1.008 . . . . 0.19 111.698 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.8 m -67.3 -36.09 80.81 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.757 -1.214 . . . . 0.2 109.949 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.7 -50.11 79.34 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.061 -1.024 . . . . 0.16 108.35 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.476 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.3 t30 -60.03 -34.47 73.42 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.256 -1.016 . . . . 0.95 108.256 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.07 -39.97 82.82 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.752 -0.592 . . . . 2.21 110.406 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.676 ' HB2' HD11 ' A' ' 22' ' ' LEU . 94.8 mt -98.95 -2.99 36.07 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.218 -0.926 . . . . 0.25 111.293 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.2 p . . . . . 0 N--CA 1.496 1.87 0 O-C-N 120.413 -1.43 . . . . 1.08 109.11 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.2 mmtt . . . . . 0 N--CA 1.493 1.689 0 N-CA-C 109.674 -0.491 . . . . 1.31 109.674 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.487 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 32.7 mm -129.02 140.11 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 N-CA-C 109.259 -0.645 . . . . 0.15 109.259 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.0 m -98.29 131.55 44.52 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 107.272 -1.381 . . . . 0.19 107.272 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -81.46 140.12 34.8 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.614 -1.304 . . . . 0.2 111.29 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.417 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.1 m95 -74.22 -10.1 59.27 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.203 -0.936 . . . . 0.21 109.697 179.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.435 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.9 m120 . . . . . 0 N--CA 1.491 1.605 0 O-C-N 121.008 -1.057 . . . . 0.49 108.76 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.9 tptt . . . . . 0 N--CA 1.499 2.013 0 N-CA-C 108.122 -1.066 . . . . 1.67 108.122 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -97.13 123.24 40.84 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.339 -0.986 . . . . 0.31 108.339 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.0 mm -100.3 112.8 34.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.774 -0.824 . . . . 0.19 108.774 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.4 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -94.63 -2.01 52.15 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 120.916 -1.115 . . . . 2.25 110.203 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -152.21 154.08 35.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.659 -1.275 . . . . 0.15 110.801 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -63.45 -32.42 73.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.258 -1.016 . . . . 1.65 108.258 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.6 m -57.89 -46.73 84.48 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.285 -0.966 . . . . 0.23 108.651 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.12 -29.53 67.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.412 -0.805 . . . . 0.17 108.992 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.401 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.6 t80 -59.85 -44.09 94.31 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.479 -0.934 . . . . 0.14 108.479 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.32 -43.64 94.03 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.016 -0.735 . . . . 1.31 109.016 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -64.29 -35.8 82.03 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.376 0.608 . . . . 1.77 109.819 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.04 -41.67 81.7 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.271 -0.893 . . . . 0.15 109.045 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.6 mt -61.0 -41.22 96.09 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.104 -1.038 . . . . 0.17 108.668 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -69.5 -39.28 77.68 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.399 -0.813 . . . . 1.07 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.36 80.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.257 -0.902 . . . . 0.18 110.405 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.82 -28.62 69.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.162 -0.961 . . . . 0.17 110.257 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.02 -130.7 30.33 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.045 -1.222 . . . . 0.2 110.045 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -89.97 2.47 55.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.124 -1.221 . . . . 1.07 110.698 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -76.73 150.44 36.26 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.902 -1.124 . . . . 1.5 109.474 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' A' ' 22' ' ' LEU . 12.2 mt -57.97 158.64 6.42 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.106 -0.996 . . . . 0.47 111.011 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.1 t -147.06 108.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.432 -0.951 . . . . 0.17 108.432 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.401 HG22 ' CD2' ' A' ' 79' ' ' PHE . 58.7 t -101.48 143.53 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.227 -1.397 . . . . 0.14 107.227 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -125.18 123.24 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.319 -0.863 . . . . 0.13 110.139 -178.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.522 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.16 123.57 42.28 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.006 -0.738 . . . . 1.05 109.006 179.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.72 24.34 8.46 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.997 -1.065 . . . . 0.73 109.601 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.424 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 46.8 m -58.47 147.9 30.14 Favored 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.09 -1.006 . . . . 0.3 110.498 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.6 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.44 127.29 34.34 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 107.422 -1.325 . . . . 0.22 107.422 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.2 t -66.93 -30.92 71.19 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.695 -1.202 . . . . 0.3 108.949 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.6 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 64.0 p-90 -76.61 -16.48 59.56 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.09 -1.006 . . . . 0.26 111.565 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -86.38 114.0 22.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.616 -1.302 . . . . 0.26 108.408 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.45 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -59.98 -51.37 59.3 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 120.317 -0.944 . . . . 0.23 111.232 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 32.8 Cg_exo -50.44 -37.6 51.71 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 CA-C-N 118.96 1.38 . . . . 0.31 112.396 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.424 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.85 -44.17 28.08 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.272 -0.893 . . . . 0.24 109.331 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -59.85 -32.02 70.29 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.534 -0.913 . . . . 1.59 108.534 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.8 ttt -60.14 -29.3 68.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.582 -0.699 . . . . 2.1 109.797 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.492 HD11 ' HB1' ' A' ' 92' ' ' ALA . 8.6 mt -83.01 -4.65 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.512 -0.743 . . . . 0.49 110.833 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.535 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.18 -32.45 10.83 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 119.701 -1.874 . . . . 0.8 113.131 -176.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.7 Cg_exo -58.82 -36.53 96.86 Favored 'Trans proline' 0 N--CA 1.493 1.446 0 CA-C-N 121.675 1.634 . . . . 0.28 112.046 -178.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.41 -51.88 18.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.822 -1.174 . . . . 0.37 109.007 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.37 -46.85 87.5 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.155 0.979 . . . . 0.16 108.744 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -68.07 -46.88 69.82 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 115.918 -0.583 . . . . 0.32 110.866 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 72.8 m -60.88 -38.87 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.091 -1.005 . . . . 0.22 110.343 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.32 -24.52 66.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.263 -0.898 . . . . 0.22 111.07 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.4 m -54.1 -37.75 64.62 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.659 -1.275 . . . . 0.16 108.109 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 73.0 mm-40 -85.44 -18.22 34.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.917 -1.114 . . . . 2.16 109.789 178.68 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -74.84 -37.03 62.35 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.052 -1.462 . . . . 1.78 107.052 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -122.99 68.07 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 107.243 -1.391 . . . . 0.25 107.243 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.6 p -64.7 -8.71 15.7 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.97 -0.752 . . . . 0.22 108.97 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -91.66 6.72 44.72 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 1.13 108.385 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.4 t -126.02 146.02 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 107.73 -1.211 . . . . 0.24 107.73 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.2 mm -99.1 124.88 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.132 -0.98 . . . . 0.15 109.73 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.53 ' C ' HD12 ' A' ' 55' ' ' LEU . 47.1 m-85 -107.09 127.74 53.75 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.288 -0.882 . . . . 0.12 109.529 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.53 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -110.93 140.21 45.62 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.047 -1.033 . . . . 0.22 110.056 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -109.77 129.89 55.57 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.52 -1.659 . . . . 1.13 106.52 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.6 t -125.37 135.09 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.193 -0.942 . . . . 0.15 110.109 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 52.5 t0 -98.19 117.44 32.57 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.745 -0.835 . . . . 1.05 108.745 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.5 m -65.01 -19.47 25.72 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 120.526 -1.359 . . . . 0.16 108.19 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.19 -41.19 11.13 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 1.08 111.949 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -97.49 -18.36 19.06 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.611 -1.306 . . . . 1.07 108.826 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -120.31 39.1 3.8 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 107.925 -1.139 . . . . 0.14 107.925 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -60.06 -19.56 53.59 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.745 -0.597 . . . . 1.47 109.702 -178.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.594 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -63.55 -35.76 81.54 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.894 -1.129 . . . . 1.05 109.066 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.594 HG23 ' OD1' ' A' ' 64' ' ' ASP . 13.2 t -73.4 -41.31 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.067 -1.021 . . . . 0.35 108.951 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.69 -41.91 78.52 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.64 -0.663 . . . . 0.26 110.638 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.0 p -60.01 -39.14 84.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.842 -1.161 . . . . 0.24 108.847 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -65.79 -40.06 91.59 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.352 -0.842 . . . . 2.06 109.465 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.61 -3.9 58.96 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.203 -0.935 . . . . 0.23 111.388 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 53.35 49.67 19.21 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.834 -1.166 . . . . 2.02 110.476 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.08 132.83 32.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 O-C-N 120.602 -1.311 . . . . 0.16 108.52 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -103.68 -12.16 17.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.396 -0.815 . . . . 1.6 110.67 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.508 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -158.4 155.36 28.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.709 -1.245 . . . . 0.14 110.905 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.44 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.9 p -129.8 154.58 81.06 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 108.007 -1.108 . . . . 0.15 108.007 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -77.04 141.92 70.8 Favored 'Cis proline' 0 N--CA 1.49 1.309 0 C-N-CA 123.666 -1.389 . . . . 0.16 112.462 -2.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.8 m -125.95 136.13 52.65 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.659 -0.867 . . . . 0.13 108.659 178.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.764 ' CD1' HD21 ' A' ' 97' ' ' LEU . 88.9 m-85 -111.75 132.95 54.31 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.505 -0.924 . . . . 0.2 108.505 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -123.83 143.23 50.46 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.661 -0.866 . . . . 0.29 108.661 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.401 ' CD2' HG22 ' A' ' 24' ' ' VAL . 59.4 m-85 -108.65 129.74 55.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.468 0.651 . . . . 0.14 110.722 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -124.15 142.26 51.37 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.86 -0.793 . . . . 0.15 108.86 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -146.44 127.05 14.2 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.531 -1.285 . . . . 1.68 107.531 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.8 mttt 60.07 28.88 18.48 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.433 -0.792 . . . . 1.22 109.282 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.94 14.42 82.02 Favored Glycine 0 N--CA 1.495 2.63 0 O-C-N 120.857 -1.152 . . . . 0.23 110.664 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -124.11 144.3 49.96 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.335 -1.097 . . . . 2.07 110.877 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -81.92 126.71 32.23 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.593 -0.692 . . . . 1.82 109.16 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.67 9.58 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.617 -0.677 . . . . 0.3 110.707 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.23 162.56 28.69 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 118.239 -1.934 . . . . 0.17 111.471 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -168.42 148.05 4.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.97 -0.752 . . . . 1.93 108.97 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.485 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 4.1 p90 -167.78 156.01 9.07 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.197 -0.94 . . . . 0.14 109.664 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.9 p -126.34 160.0 31.61 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.563 -0.71 . . . . 0.12 109.997 -179.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.44 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.14 141.51 5.78 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.471 -1.452 . . . . 0.12 109.471 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.492 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.16 65.41 2.13 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.288 -1.125 . . . . 0.18 110.056 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.52 97.71 5.78 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.642 -0.873 . . . . 0.88 108.642 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -32.47 71.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.069 -1.019 . . . . 1.06 111.732 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -64.25 -30.05 71.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.082 -1.011 . . . . 1.61 109.321 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -60.42 -35.47 75.86 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.301 -0.629 . . . . 1.45 109.301 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.764 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.0 mt -59.79 -39.87 86.41 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.145 0.974 . . . . 0.19 108.797 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -63.24 -40.43 97.41 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.967 -0.693 . . . . 2.1 110.755 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -44.3 72.45 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.078 -1.013 . . . . 0.19 111.754 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.0 m -67.11 -38.55 85.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.771 -1.205 . . . . 0.2 109.819 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.7 mt -60.91 -49.93 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.187 -0.946 . . . . 0.16 108.494 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.01 -36.38 77.08 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 122.055 0.931 . . . . 0.95 109.074 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -67.2 -40.16 86.45 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.732 -0.605 . . . . 2.21 110.38 -178.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.3 mt -99.36 -4.7 31.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.12 -0.988 . . . . 0.25 111.225 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.497 1.901 0 O-C-N 120.207 -1.558 . . . . 1.08 109.366 -178.71 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.4 mmtm . . . . . 0 N--CA 1.489 1.501 0 N-CA-C 109.458 -0.571 . . . . 1.31 109.458 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.44 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.8 mm -128.9 141.57 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.896 -0.503 . . . . 0.15 110.169 -179.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.5 m -101.21 128.25 47.42 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.799 -1.556 . . . . 0.19 106.799 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.9 m -79.84 141.1 36.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.759 -1.213 . . . . 0.2 110.442 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.508 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.2 m95 -74.47 -12.23 60.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.217 -0.927 . . . . 0.21 109.316 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.488 1.437 0 O-C-N 121.145 -0.972 . . . . 0.49 108.919 -179.982 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.3 tptt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 108.486 -0.931 . . . . 1.67 108.486 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.41 125.1 41.84 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.227 -0.921 . . . . 0.31 108.829 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.9 mm -103.03 113.6 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 108.382 -0.97 . . . . 0.19 108.382 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -96.88 -0.64 47.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.011 -1.056 . . . . 2.25 109.843 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -154.7 156.53 36.56 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.014 -1.054 . . . . 0.15 110.802 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -63.62 -31.95 73.27 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.289 -1.004 . . . . 1.65 108.289 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.451 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 59.3 m -57.15 -48.21 79.25 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.403 -0.919 . . . . 0.23 108.826 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.36 -28.82 66.54 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.205 -0.934 . . . . 0.17 108.959 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.476 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.0 t80 -59.9 -43.94 94.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.323 -0.861 . . . . 0.14 109.272 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -65.59 -42.55 91.57 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.823 -0.751 . . . . 1.31 109.052 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.55 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.67 -40.05 95.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 1.77 110.394 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.24 90.86 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.137 -0.977 . . . . 0.15 109.239 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.476 HD11 ' CE2' ' A' ' 11' ' ' PHE . 80.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.222 -1.029 . . . . 0.17 108.222 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -70.07 -35.31 74.13 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.926 -0.71 . . . . 1.07 110.127 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.05 -36.65 77.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.095 -1.003 . . . . 0.18 110.001 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.32 -34.76 77.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.918 -1.114 . . . . 0.17 109.507 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.37 -124.52 19.2 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 110.125 -1.19 . . . . 0.2 110.125 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -91.92 5.2 50.97 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.943 -1.328 . . . . 1.07 110.307 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -77.29 149.33 35.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.004 -1.06 . . . . 1.5 109.021 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.681 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -61.2 156.49 18.31 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.614 -1.254 . . . . 0.47 107.614 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.647 ' H ' HD23 ' A' ' 22' ' ' LEU . 84.5 t -143.78 113.04 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.807 -1.183 . . . . 0.17 109.205 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.3 t -101.22 142.39 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.392 -0.966 . . . . 0.14 108.392 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -125.42 121.96 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.218 -0.926 . . . . 0.13 109.582 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -98.82 120.9 40.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.355 -0.841 . . . . 1.05 110.346 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -95.94 24.43 5.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.73 109.49 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -59.22 145.79 41.53 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.154 -0.966 . . . . 0.3 110.545 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.654 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.21 123.3 31.33 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.406 -0.961 . . . . 0.22 108.406 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.91 -30.96 70.42 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.91 -1.144 . . . . 0.3 107.91 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.654 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 55.8 p-90 -71.38 -26.38 62.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.373 -0.829 . . . . 0.26 110.6 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.27 123.68 29.83 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.803 -1.186 . . . . 0.26 107.967 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.423 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.08 -53.07 32.06 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.506 -0.854 . . . . 0.23 111.534 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.4 Cg_exo -51.55 -31.96 41.9 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 CA-C-N 118.704 1.252 . . . . 0.31 112.095 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.38 -50.67 10.48 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.377 -0.827 . . . . 0.24 109.725 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.67 -39.27 83.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.282 -0.887 . . . . 1.59 109.468 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.3 ttm -57.6 -27.7 62.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.474 -0.766 . . . . 2.1 109.622 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.559 HG22 ' O ' ' A' ' 38' ' ' ILE . 66.3 mt -85.29 -2.99 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.49 111.374 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.35 -30.13 6.22 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 120.447 -1.408 . . . . 0.8 113.454 -179.289 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 33.8 Cg_exo -59.28 -41.62 57.47 Favored 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 121.52 1.578 . . . . 0.28 113.642 -176.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.98 -45.27 74.59 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 117.589 -1.644 . . . . 0.37 107.771 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -59.69 -54.37 47.14 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.202 -0.936 . . . . 0.16 110.239 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.4 t60 -68.24 -40.0 82.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.546 -0.721 . . . . 0.32 110.866 -179.477 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.5 m -61.18 -39.03 88.61 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.823 -1.173 . . . . 0.22 110.755 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -61.93 -22.51 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.143 -0.973 . . . . 0.22 110.901 -178.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.9 m -54.12 -35.45 62.2 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 120.82 -1.175 . . . . 0.16 108.457 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -88.26 -14.78 37.55 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.485 -0.759 . . . . 2.16 108.961 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.34 -36.21 39.8 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 106.955 -1.498 . . . . 1.78 106.955 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.413 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 78.0 m-85 -124.82 68.83 1.1 Allowed 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.29 -1.374 . . . . 0.25 107.29 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 71.7 p -65.11 -8.5 16.97 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.496 -0.752 . . . . 0.22 109.188 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -89.02 6.09 41.34 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.456 HG13 ' HB3' ' A' ' 22' ' ' LEU . 41.6 t -126.09 145.56 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 107.441 -1.318 . . . . 0.24 107.441 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.0 122.24 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.159 0 O-C-N 121.164 -0.96 . . . . 0.15 109.456 -178.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.581 ' C ' HD12 ' A' ' 55' ' ' LEU . 38.1 m-85 -103.12 125.17 49.71 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.317 -0.864 . . . . 0.12 109.549 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.581 HD12 ' C ' ' A' ' 54' ' ' PHE . 6.0 mp -110.09 142.04 42.1 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -0.999 . . . . 0.22 109.585 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -109.41 132.33 54.23 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 106.897 -1.52 . . . . 1.13 106.897 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.2 t -130.28 134.17 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 121.231 -0.918 . . . . 0.15 110.856 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 40.8 t0 -96.35 120.85 37.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.564 -0.71 . . . . 1.05 109.44 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.4 m -67.81 -19.35 24.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.635 -1.29 . . . . 0.16 108.464 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.9 m-20 -92.24 -43.68 9.17 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.483 -0.761 . . . . 1.08 111.446 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.44 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 33.4 m-20 -93.25 -21.87 19.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.535 -1.353 . . . . 1.07 108.355 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -117.61 38.57 3.57 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 107.982 -1.118 . . . . 0.14 107.982 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -59.83 -22.19 61.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.814 -0.554 . . . . 1.47 109.903 -178.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.601 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -63.93 -38.86 92.63 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.123 -0.986 . . . . 1.05 108.943 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.601 HG23 ' OD1' ' A' ' 64' ' ' ASP . 12.0 t -72.48 -43.98 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 O-C-N 121.319 -0.863 . . . . 0.35 109.952 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -40.16 75.63 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.564 -0.71 . . . . 0.26 111.118 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -63.02 -32.69 74.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.909 -1.119 . . . . 0.24 108.884 -179.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -39.89 95.64 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.839 -0.8 . . . . 2.06 108.839 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.28 0.52 56.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.601 -0.687 . . . . 0.23 109.872 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 54.52 50.17 16.64 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.273 -0.892 . . . . 2.02 109.718 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.37 131.35 28.88 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 C-N-CA 118.153 -1.419 . . . . 0.16 108.732 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -104.86 -10.48 17.31 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.94 -0.475 . . . . 1.6 110.15 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.93 152.28 15.24 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.834 -1.166 . . . . 0.14 110.915 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -124.99 154.12 71.24 Favored Pre-proline 0 N--CA 1.5 2.07 0 N-CA-C 107.388 -1.338 . . . . 0.15 107.388 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -77.37 144.21 76.97 Favored 'Cis proline' 0 N--CA 1.487 1.107 0 C-N-CA 123.601 -1.416 . . . . 0.16 112.062 -2.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.3 m -129.96 133.87 47.08 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.199 -1.037 . . . . 0.13 108.199 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.425 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 84.1 m-85 -112.46 132.24 55.16 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.356 -0.979 . . . . 0.2 108.356 -179.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -123.15 142.79 50.51 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.285 -0.884 . . . . 0.29 108.976 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -108.17 132.12 53.95 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-O 121.712 0.768 . . . . 0.14 111.395 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -125.77 145.44 50.2 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.239 -0.652 . . . . 0.15 109.239 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -147.7 131.44 16.96 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.251 -1.389 . . . . 1.68 107.251 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 59.0 mttp 56.22 26.76 10.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.564 -1.273 . . . . 1.22 107.564 -177.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.07 17.46 79.68 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 110.354 -1.098 . . . . 0.23 110.354 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.442 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.7 mm-40 -117.93 136.71 53.31 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.47 -1.018 . . . . 2.07 109.869 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -79.41 122.21 26.13 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.119 -0.988 . . . . 1.82 108.457 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 19.0 m -122.82 11.88 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.595 -0.691 . . . . 0.3 111.304 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.26 155.46 15.99 Favored Glycine 0 N--CA 1.496 2.694 0 C-N-CA 118.589 -1.767 . . . . 0.17 111.254 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.512 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.54 148.18 7.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.809 -0.818 . . . . 1.93 109.478 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.512 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.8 p90 -167.05 159.03 12.77 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.353 -0.842 . . . . 0.14 110.05 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.5 p -127.08 161.41 28.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.647 -0.658 . . . . 0.12 109.486 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.508 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.77 141.71 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 108.995 -1.642 . . . . 0.12 108.995 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.511 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -80.16 67.12 5.87 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.391 -1.064 . . . . 0.18 110.078 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.1 t-20 -120.25 99.37 6.55 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.355 -0.98 . . . . 0.88 108.355 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.493 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -67.82 -32.25 72.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 1.06 111.726 -178.822 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -65.97 -28.07 68.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.594 -1.317 . . . . 1.61 109.643 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.46 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 21.6 ttmt -61.0 -35.26 76.37 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 108.779 -0.822 . . . . 1.45 108.779 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 75.1 mt -59.64 -38.83 82.44 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.101 0.953 . . . . 0.19 108.949 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . 0.413 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 9.6 tp10 -63.23 -43.52 97.83 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 120.109 -0.637 . . . . 2.1 111.53 -177.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.11 -43.64 77.98 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.988 -1.07 . . . . 0.19 111.613 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.08 -40.13 94.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.739 -1.226 . . . . 0.2 109.739 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.0 mt -60.05 -50.02 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.155 -1.054 . . . . 0.16 108.155 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.477 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.9 t-20 -59.7 -35.3 74.23 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 122.041 0.924 . . . . 0.95 108.588 178.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -67.89 -39.84 83.59 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.532 -0.73 . . . . 2.21 109.971 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.681 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.8 mt -99.99 -0.89 38.42 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.214 -0.929 . . . . 0.25 111.273 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.7 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 120.481 -1.387 . . . . 1.08 109.265 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 68.3 mmtt . . . . . 0 N--CA 1.497 1.899 0 N-CA-C 109.559 -0.534 . . . . 1.31 109.559 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.508 HD11 ' HA2' ' A' ' 91' ' ' GLY . 38.3 mm -128.77 141.05 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 N-CA-C 109.541 -0.54 . . . . 0.15 109.541 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 34.7 m -98.47 127.27 44.33 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.837 -1.542 . . . . 0.19 106.837 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -77.54 139.36 39.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.688 -1.258 . . . . 0.2 110.738 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.472 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 21.1 m95 -74.52 -10.9 60.01 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.122 -0.987 . . . . 0.21 109.253 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 . . . . . 0 N--CA 1.492 1.675 0 O-C-N 121.425 -0.797 . . . . 0.49 109.16 179.665 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.1 tptt . . . . . 0 N--CA 1.492 1.653 0 N-CA-C 108.881 -0.785 . . . . 1.67 108.881 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -94.71 126.16 39.84 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.898 -1.519 . . . . 0.31 106.898 178.074 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.9 mm -100.19 115.62 41.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 121.341 -0.85 . . . . 0.19 108.743 -179.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -98.55 -1.61 40.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.284 -0.885 . . . . 2.25 110.091 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.52 157.45 39.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.024 -1.048 . . . . 0.15 111.273 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.536 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 27.8 ttpt -66.74 -31.72 72.55 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.729 -1.211 . . . . 1.65 107.729 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 23.8 m -56.31 -48.11 77.36 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.703 -0.851 . . . . 0.23 108.703 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.1 -32.33 68.91 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.935 -0.765 . . . . 0.17 108.935 178.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.547 ' CE2' HD11 ' A' ' 15' ' ' LEU . 53.8 t80 -57.02 -42.86 81.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.887 . . . . 0.14 108.802 -179.15 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.01 -42.21 89.98 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 109.024 -0.732 . . . . 1.31 109.024 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.04 -38.56 91.28 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.201 0.525 . . . . 1.77 110.913 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.48 -40.53 89.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.059 -1.026 . . . . 0.15 109.176 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.547 HD11 ' CE2' ' A' ' 11' ' ' PHE . 75.0 mt -60.89 -39.98 91.3 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.412 -0.805 . . . . 0.17 109.412 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -70.24 -34.66 73.11 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.458 -0.776 . . . . 1.07 110.164 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.2 78.0 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.18 110.088 -178.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.44 -32.41 71.34 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.279 -0.888 . . . . 0.17 109.299 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.06 -127.25 27.21 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.197 -1.561 . . . . 0.2 109.197 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -90.79 4.08 52.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.109 -1.23 . . . . 1.07 110.693 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.6 mttm -75.13 148.97 39.21 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.846 -1.159 . . . . 1.5 109.633 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.7 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.01 155.85 19.16 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.333 -1.358 . . . . 0.47 107.333 179.591 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.7 ' H ' HD23 ' A' ' 22' ' ' LEU . 47.3 t -145.13 121.77 4.15 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 N-CA-C 107.826 -1.175 . . . . 0.17 107.826 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.2 t -110.29 141.07 26.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 108.062 -1.088 . . . . 0.14 108.062 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.8 t -122.51 121.38 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.337 -0.852 . . . . 0.13 109.199 -179.45 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.569 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.7 t70 -99.34 109.31 21.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.46 -0.775 . . . . 1.05 111.114 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -89.88 104.66 17.2 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.688 -1.597 . . . . 0.73 106.688 176.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.2 m -129.99 144.21 51.21 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.622 -0.881 . . . . 0.3 108.622 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.618 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.31 122.39 27.89 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.461 -1.311 . . . . 0.22 107.461 178.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -64.43 -33.13 75.15 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.209 -1.034 . . . . 0.3 108.209 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.618 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.0 p-90 -71.8 -27.25 62.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.414 -0.803 . . . . 0.26 110.541 179.283 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -82.69 115.82 21.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.981 -1.075 . . . . 0.26 108.549 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.457 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.42 -51.9 54.89 Favored Glycine 0 N--CA 1.484 1.876 0 C-N-CA 120.535 -0.841 . . . . 0.23 111.329 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -52.03 -35.48 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 CA-C-N 118.689 1.245 . . . . 0.31 112.734 -179.153 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.83 -54.83 6.31 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.149 -0.969 . . . . 0.24 110.187 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -61.19 -36.28 79.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.114 -0.991 . . . . 1.59 109.76 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 30.0 ttp -58.1 -27.39 63.65 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.26 -0.9 . . . . 2.1 109.041 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.551 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -87.52 -9.19 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 112.178 0.436 . . . . 0.49 112.178 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.544 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 30.1 pttt -68.2 -30.45 2.66 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 119.965 -1.709 . . . . 0.8 113.437 -177.545 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.6 Cg_exo -49.83 -37.55 45.63 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 CA-C-N 121.843 1.694 . . . . 0.28 112.826 -178.54 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -68.09 -42.88 79.67 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 117.359 -1.736 . . . . 0.37 106.857 178.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -61.13 -53.64 54.54 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.349 -0.844 . . . . 0.16 109.815 178.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -67.73 -40.4 84.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.32 110.78 -179.622 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.409 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 71.2 m -60.44 -39.92 89.24 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.117 -0.989 . . . . 0.22 111.442 -179.611 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.91 -20.2 65.67 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.093 -1.004 . . . . 0.22 110.88 -177.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.7 m -51.28 -39.86 57.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.851 -1.156 . . . . 0.16 109.211 -178.559 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -81.33 -17.44 49.16 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.246 -0.909 . . . . 2.16 109.588 179.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -76.87 -38.4 53.72 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.273 -1.38 . . . . 1.78 107.273 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -121.21 68.72 0.89 Allowed 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 106.298 -1.742 . . . . 0.25 106.298 177.672 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -63.11 -9.02 9.03 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.707 -0.849 . . . . 0.22 108.707 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -91.14 8.53 35.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.684 -0.635 . . . . 1.13 109.433 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 22' ' ' LEU . 49.4 t -126.86 147.02 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 107.849 -1.167 . . . . 0.24 107.849 179.284 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.2 mm -99.53 120.96 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 120.987 -1.071 . . . . 0.15 109.794 -178.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.561 ' C ' HD12 ' A' ' 55' ' ' LEU . 57.1 m-85 -102.9 123.89 47.38 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.38 -0.825 . . . . 0.12 109.728 179.714 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.561 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -111.73 142.06 44.55 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.038 -1.039 . . . . 0.22 110.225 178.633 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.34 133.04 53.64 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 107.498 -1.297 . . . . 1.13 107.498 177.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.8 t -128.99 139.05 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.312 -0.868 . . . . 0.15 111.604 -178.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.613 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.1 t0 -102.28 120.04 39.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.135 -0.691 . . . . 1.05 109.135 179.433 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -68.13 -18.65 23.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.797 -1.189 . . . . 0.16 108.471 178.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -92.37 -41.53 10.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.387 -0.821 . . . . 1.08 111.608 -178.736 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -95.93 -15.05 22.62 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.602 -1.311 . . . . 1.07 108.122 179.085 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.64 39.69 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.228 -1.397 . . . . 0.14 107.228 179.031 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -60.98 -20.1 61.95 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.307 0.575 . . . . 1.47 109.48 -178.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.536 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 5.0 p-10 -67.4 -39.95 85.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.261 -0.899 . . . . 1.05 109.653 179.505 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -73.13 -42.55 58.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.659 0.743 . . . . 0.35 109.655 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -39.97 72.62 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.491 -0.756 . . . . 0.26 110.431 -179.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.7 p -60.46 -35.77 76.67 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.096 -1.003 . . . . 0.24 108.766 -179.537 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -62.41 -39.88 94.7 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.509 -0.745 . . . . 2.06 109.393 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.06 -1.73 57.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 0.23 111.164 -178.878 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 54.85 50.02 16.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.078 -1.014 . . . . 2.02 109.391 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.3 t -66.79 131.54 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.881 -1.137 . . . . 0.16 109.188 -178.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -103.95 -10.77 17.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.626 -0.672 . . . . 1.6 110.23 -179.534 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.58 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -162.24 155.32 20.24 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.829 -1.169 . . . . 0.14 110.434 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -130.1 153.86 81.18 Favored Pre-proline 0 N--CA 1.501 2.077 0 N-CA-C 107.818 -1.178 . . . . 0.15 107.818 179.017 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -75.66 142.56 74.39 Favored 'Cis proline' 0 N--CA 1.496 1.624 0 C-N-CA 123.73 -1.363 . . . . 0.16 113.192 -2.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.443 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -125.71 132.25 52.42 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.147 -1.057 . . . . 0.13 108.147 177.602 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.569 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 89.0 m-85 -108.2 130.64 55.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.742 -0.836 . . . . 0.2 108.742 -179.261 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -122.38 141.25 51.77 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.135 -1.061 . . . . 0.29 108.135 179.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -108.66 132.41 53.94 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.559 0.695 . . . . 0.14 110.643 -178.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -125.95 146.01 50.04 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.497 0.665 . . . . 0.15 109.925 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -149.59 131.14 14.85 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 107.975 -1.12 . . . . 1.68 107.975 179.062 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 57.34 27.52 13.9 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.467 -0.938 . . . . 1.22 108.467 -178.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.96 21.47 76.22 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.887 -1.285 . . . . 0.23 109.887 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -127.79 142.68 51.24 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -1.091 . . . . 2.07 110.043 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.447 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 76.3 tttt -79.96 129.79 34.77 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.014 -1.054 . . . . 1.82 109.166 179.665 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.4 m -123.01 4.6 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.637 -0.665 . . . . 0.3 110.741 -179.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 173.84 161.03 23.25 Favored Glycine 0 N--CA 1.495 2.577 0 C-N-CA 118.218 -1.944 . . . . 0.17 111.844 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.447 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 58.2 tt0 -163.9 151.88 12.88 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.714 -0.874 . . . . 1.93 109.479 179.04 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.473 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 6.7 p90 -166.72 157.15 11.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.435 -0.791 . . . . 0.14 109.781 177.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -127.51 163.05 24.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.812 0.815 . . . . 0.12 110.753 -178.606 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.477 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.63 143.96 7.15 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.208 -1.557 . . . . 0.12 109.208 179.373 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.85 67.14 2.21 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.364 -1.08 . . . . 0.18 110.403 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.2 91.19 3.48 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 108.455 -0.943 . . . . 0.88 108.455 178.197 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.73 72.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.022 -1.048 . . . . 1.06 111.353 -179.162 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -65.29 -29.84 70.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.753 -1.217 . . . . 1.61 109.961 -179.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.473 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 56.1 tttm -60.32 -35.8 76.44 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.374 -0.829 . . . . 1.45 109.296 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' A' ' 77' ' ' PHE . 58.0 mt -58.09 -39.24 78.1 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.738 -0.838 . . . . 0.19 108.738 179.685 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -61.8 -43.67 98.39 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 119.883 -0.727 . . . . 2.1 110.964 -178.407 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.39 -43.23 77.76 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.011 -1.055 . . . . 0.19 111.357 -178.709 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -64.63 -39.55 93.89 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.824 -1.173 . . . . 0.2 110.158 -178.285 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.44 -48.38 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.126 -0.984 . . . . 0.16 108.428 179.168 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.452 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.6 t-20 -59.95 -37.05 78.41 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.104 0.954 . . . . 0.95 108.689 179.226 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -67.33 -38.81 85.51 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.79 -0.569 . . . . 2.21 110.088 -178.341 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.652 ' HB2' HD11 ' A' ' 22' ' ' LEU . 79.6 mt -100.07 -2.88 33.16 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.918 -1.114 . . . . 0.25 111.367 -179.269 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.3 p . . . . . 0 N--CA 1.496 1.845 0 O-C-N 120.48 -1.388 . . . . 1.08 109.347 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 30.1 mmtp . . . . . 0 N--CA 1.495 1.808 0 N-CA-C 109.332 -0.618 . . . . 1.31 109.332 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.58 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 30.7 mm -130.74 141.07 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 N-CA-C 109.497 -0.557 . . . . 0.15 109.497 -179.607 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 64.9 m -95.91 131.66 42.02 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.518 -1.289 . . . . 0.19 107.518 177.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -80.18 139.32 36.83 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.811 -1.18 . . . . 0.2 111.384 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.443 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.1 m95 -78.03 -9.46 59.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.061 -1.024 . . . . 0.21 108.813 178.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--N 1.304 -1.377 0 O-C-N 121.136 -0.978 . . . . 0.49 108.525 -179.936 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.1 tptp . . . . . 0 N--CA 1.495 1.775 0 N-CA-C 108.185 -1.042 . . . . 1.67 108.185 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -95.06 123.75 38.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.008 -1.058 . . . . 0.31 109.027 179.788 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.87 111.97 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.513 -0.921 . . . . 0.19 108.513 179.509 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -96.64 -0.2 48.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.168 -0.957 . . . . 2.25 110.212 -179.355 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.43 156.89 36.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.787 -1.196 . . . . 0.15 110.803 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.457 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 33.5 ttmt -64.04 -32.76 74.42 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.8 -1.185 . . . . 1.65 107.8 177.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.9 m -56.13 -48.34 76.43 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.425 -0.91 . . . . 0.23 108.963 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.55 -31.36 70.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.247 -0.908 . . . . 0.17 109.28 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.498 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.2 t80 -58.99 -44.66 91.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.14 109.549 -178.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -64.11 -40.99 97.4 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.202 -1.036 . . . . 1.31 108.202 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -65.15 -36.7 85.06 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.562 0.696 . . . . 1.77 110.344 179.401 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.79 -43.84 78.76 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.795 -0.817 . . . . 0.15 108.795 -179.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.498 HD11 ' CE2' ' A' ' 11' ' ' PHE . 89.6 mt -60.67 -39.5 88.65 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.376 -0.972 . . . . 0.17 108.376 178.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.01 -32.96 72.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.428 -0.795 . . . . 1.07 109.962 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.2 63.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.13 -0.981 . . . . 0.18 110.539 -179.211 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.52 -30.08 70.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.05 -1.031 . . . . 0.17 109.555 -179.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.9 -127.37 24.96 Favored Glycine 0 N--CA 1.487 2.089 0 N-CA-C 110.08 -1.208 . . . . 0.2 110.08 -179.895 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -92.78 4.24 54.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.362 -1.081 . . . . 1.07 110.44 -179.139 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -75.45 151.33 38.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.172 -0.955 . . . . 1.5 109.388 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.677 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -61.3 156.03 19.78 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 107.54 -1.282 . . . . 0.47 107.54 -179.732 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.634 ' H ' HD23 ' A' ' 22' ' ' LEU . 60.7 t -142.69 119.57 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.064 -1.023 . . . . 0.17 108.469 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -105.89 139.82 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 N-CA-C 107.72 -1.215 . . . . 0.14 107.72 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 32.9 t -123.58 120.3 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.151 -0.968 . . . . 0.13 109.295 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -98.53 118.51 35.39 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.375 -0.828 . . . . 1.05 110.079 179.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -94.63 24.83 4.34 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.09 -1.007 . . . . 0.73 109.803 179.16 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.408 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.8 m -60.16 147.69 38.86 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.01 -1.056 . . . . 0.3 110.618 -179.011 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.774 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.83 124.0 31.09 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.602 -1.259 . . . . 0.22 107.602 178.81 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.4 t -66.96 -29.2 68.99 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 108.098 -1.075 . . . . 0.3 108.098 179.694 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.774 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 63.9 p-90 -75.53 -19.09 59.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.521 -0.737 . . . . 0.26 110.435 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.424 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 7.0 t -87.29 111.7 21.31 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.668 -1.234 . . . . 0.26 107.668 179.971 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.71 -50.93 62.42 Favored Glycine 0 N--CA 1.486 1.992 0 C-N-CA 120.557 -0.83 . . . . 0.23 111.379 -178.13 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.78 -35.94 50.07 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 CA-C-N 118.964 1.382 . . . . 0.31 111.234 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.54 -45.11 22.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.378 -0.826 . . . . 0.24 109.826 179.222 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -59.95 -31.34 69.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.162 -0.961 . . . . 1.59 108.841 179.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.521 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.2 tmm? -60.37 -29.59 69.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.582 -0.699 . . . . 2.1 109.642 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.465 HD11 ' HB1' ' A' ' 92' ' ' ALA . 9.5 mt -81.12 -5.56 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.741 -0.6 . . . . 0.49 111.106 -179.434 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.42 -30.86 7.78 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 119.881 -1.762 . . . . 0.8 112.971 -176.787 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.0 Cg_exo -59.72 -38.46 80.87 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 CA-C-N 121.722 1.651 . . . . 0.28 112.29 -178.529 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -71.43 -50.82 28.01 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.412 -1.315 . . . . 0.37 108.759 179.449 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.7 -48.64 80.88 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.217 -0.927 . . . . 0.16 109.252 179.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -67.5 -44.74 77.75 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.681 -0.637 . . . . 0.32 110.969 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 63.4 m -62.13 -36.42 81.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.953 -1.092 . . . . 0.22 110.35 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 mt -60.13 -26.12 66.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.198 -0.939 . . . . 0.22 110.477 -178.631 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.5 m -53.45 -41.79 66.5 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.79 -1.194 . . . . 0.16 108.428 -179.495 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.415 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 39.9 mp0 -86.06 -16.86 36.79 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.299 -0.876 . . . . 2.16 110.049 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -78.03 -37.22 47.39 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 106.516 -1.661 . . . . 1.78 106.516 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -123.12 70.03 1.02 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.266 -1.383 . . . . 0.25 107.266 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.6 p -65.67 -7.83 17.42 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.835 -0.802 . . . . 0.22 108.835 -179.498 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -88.47 3.9 48.47 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.685 -0.857 . . . . 1.13 108.685 179.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.414 HG13 ' HB3' ' A' ' 22' ' ' LEU . 39.7 t -126.4 145.56 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.562 -1.273 . . . . 0.24 107.562 178.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mm -98.67 121.86 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.045 . . . . 0.15 109.574 -178.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.607 ' C ' HD12 ' A' ' 55' ' ' LEU . 39.9 m-85 -102.63 123.86 47.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.24 -0.912 . . . . 0.12 109.747 179.525 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.607 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -110.39 140.16 44.89 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.266 -0.896 . . . . 0.22 109.696 178.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -109.98 130.0 55.59 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 106.831 -1.544 . . . . 1.13 106.831 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.9 136.72 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 CA-C-O 121.51 0.671 . . . . 0.15 110.474 -178.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.637 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.8 t0 -98.92 121.69 41.2 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 1.05 109.729 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -68.31 -17.49 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 120.98 -1.075 . . . . 0.16 108.702 179.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.7 m-20 -94.48 -41.99 9.08 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.525 -0.735 . . . . 1.08 111.591 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -96.91 -13.86 22.16 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.644 -1.285 . . . . 1.07 108.476 179.506 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.63 37.88 4.31 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.052 -1.462 . . . . 0.14 107.052 179.6 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.28 -21.85 62.43 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.972 -0.751 . . . . 1.47 108.972 -178.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.457 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 2.6 p30 -64.86 -39.64 93.87 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.134 -0.979 . . . . 1.05 108.964 179.215 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.5 t -73.59 -44.13 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.394 -0.816 . . . . 0.35 109.781 -179.65 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.27 72.03 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.381 -0.824 . . . . 0.26 110.71 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.8 p -61.2 -32.86 72.62 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.998 -1.064 . . . . 0.24 109.091 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -64.65 -39.92 94.54 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.488 -0.757 . . . . 2.06 110.19 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.81 1.66 53.34 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.292 -0.88 . . . . 0.23 110.677 -178.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 55.79 49.64 15.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.02 109.58 -179.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.77 130.65 30.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 C-N-CA 118.468 -1.293 . . . . 0.16 108.373 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -104.53 -10.8 17.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.628 -0.67 . . . . 1.6 109.968 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.478 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -161.78 155.85 22.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.9 -1.125 . . . . 0.14 110.991 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.68 156.26 79.08 Favored Pre-proline 0 N--CA 1.498 1.974 0 N-CA-C 107.819 -1.178 . . . . 0.15 107.819 179.087 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -76.06 139.67 61.78 Favored 'Cis proline' 0 N--CA 1.497 1.681 0 C-N-CA 123.969 -1.263 . . . . 0.16 112.611 -2.489 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -124.43 135.63 53.41 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 108.772 -0.825 . . . . 0.13 108.772 178.391 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.697 ' CD1' HD21 ' A' ' 97' ' ' LEU . 90.1 m-85 -113.12 131.75 55.71 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 109.121 -0.696 . . . . 0.2 109.121 -179.572 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -122.09 140.09 52.93 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.139 -1.06 . . . . 0.29 108.139 178.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -107.65 133.41 52.12 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.775 -0.578 . . . . 0.14 110.198 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -126.23 148.65 49.43 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.013 -0.736 . . . . 0.15 109.013 179.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -148.58 126.82 12.17 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 107.644 -1.243 . . . . 1.68 107.644 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.1 mttp 57.63 25.23 11.42 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.704 -1.221 . . . . 1.22 107.704 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.5 16.88 77.03 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 110.096 -1.202 . . . . 0.23 110.096 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 4.7 mm-40 -116.23 135.67 53.7 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.482 -1.011 . . . . 2.07 109.964 -179.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.461 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 80.9 tttt -81.54 122.5 27.65 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.307 -0.997 . . . . 1.82 108.307 178.32 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.3 m -123.29 9.87 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.648 -0.658 . . . . 0.3 110.811 -179.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.56 151.67 9.72 Favored Glycine 0 N--CA 1.499 2.885 0 C-N-CA 118.184 -1.96 . . . . 0.17 112.201 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.461 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 67.9 tt0 -164.48 151.22 11.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.684 -0.892 . . . . 1.93 109.341 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 21.5 p90 -163.21 161.27 24.82 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.768 -0.827 . . . . 0.14 108.768 177.423 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -125.92 160.05 30.97 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.554 0.692 . . . . 0.12 110.059 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.5 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.76 141.97 5.8 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.851 -1.699 . . . . 0.12 108.851 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.73 65.28 4.85 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.101 -1.235 . . . . 0.18 109.818 -179.553 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.9 t-20 -119.46 100.21 7.15 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.142 -1.058 . . . . 0.88 108.142 178.538 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.443 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.09 -32.36 72.63 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.346 -0.846 . . . . 1.06 111.538 -179.026 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.48 -29.55 70.22 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.968 -1.082 . . . . 1.61 109.812 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.502 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 78.2 tttt -60.18 -38.28 82.75 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.982 -0.748 . . . . 1.45 108.982 -179.153 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' CD1' ' A' ' 77' ' ' PHE . 44.1 mt -57.14 -39.43 75.17 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.993 0.902 . . . . 0.19 108.743 179.431 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -61.66 -41.99 98.29 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 120.074 -0.65 . . . . 2.1 110.632 -177.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.41 -44.09 75.78 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.261 -0.899 . . . . 0.19 111.227 -179.095 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.2 m -66.16 -40.01 90.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.899 -1.126 . . . . 0.2 109.903 -178.445 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -60.92 -49.73 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 107.987 -1.116 . . . . 0.16 107.987 178.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.5 t-20 -59.95 -35.35 74.76 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.853 0.835 . . . . 0.95 108.752 178.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -67.19 -39.99 86.46 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.715 -0.616 . . . . 2.21 110.019 -178.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.0 mt -100.25 -1.87 35.26 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.316 -0.865 . . . . 0.25 111.206 -178.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.4 p . . . . . 0 N--CA 1.498 1.974 0 O-C-N 120.554 -1.341 . . . . 1.08 109.269 -179.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt . . . . . 0 N--CA 1.491 1.588 0 N-CA-C 109.539 -0.541 . . . . 1.31 109.539 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.5 HD11 ' HA2' ' A' ' 91' ' ' GLY . 30.3 mm -131.72 141.86 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 121.672 -0.642 . . . . 0.15 109.527 -179.765 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -101.73 126.5 48.6 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 107.688 -1.227 . . . . 0.19 107.688 177.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -76.97 144.35 38.82 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.988 -1.07 . . . . 0.2 110.813 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.478 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.5 m95 -79.47 -17.04 55.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.334 -0.854 . . . . 0.21 109.44 179.409 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--N 1.302 -1.477 0 N-CA-C 107.868 -1.16 . . . . 0.49 107.868 179.369 . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 18.4 tptp . . . . . 0 N--CA 1.496 1.874 0 N-CA-C 107.787 -1.19 . . . . 1.67 107.787 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -96.13 121.97 38.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.16 -0.963 . . . . 0.31 108.882 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.2 mm -102.21 117.5 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 107.793 -1.188 . . . . 0.19 107.793 179.379 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.7 mp0 -99.38 -0.75 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.921 -1.112 . . . . 2.25 109.993 -178.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.83 158.11 38.91 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.973 -1.079 . . . . 0.15 110.942 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -63.1 -32.79 74.25 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.467 -0.938 . . . . 1.65 108.467 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.0 m -57.65 -47.89 81.0 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.114 -0.991 . . . . 0.23 108.811 -179.484 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.18 -31.15 70.49 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.253 -0.905 . . . . 0.17 108.694 178.551 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.427 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.0 t80 -59.4 -43.86 92.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.14 108.655 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -66.05 -41.81 90.33 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.912 -0.773 . . . . 1.31 108.912 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -65.52 -35.68 81.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 1.77 110.307 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.04 -41.35 77.78 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.13 -0.982 . . . . 0.15 109.268 -179.406 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.427 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.7 mt -61.09 -39.9 91.67 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.192 -0.943 . . . . 0.17 108.549 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.17 -35.39 76.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.651 -0.655 . . . . 1.07 109.999 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.54 -35.85 75.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.293 -0.88 . . . . 0.18 110.486 -179.142 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.63 75.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.082 -1.011 . . . . 0.17 109.867 -179.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.07 -126.11 22.75 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.882 -1.287 . . . . 0.2 109.882 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -90.96 3.48 54.53 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.035 -1.273 . . . . 1.07 110.269 -178.886 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mttt -75.4 150.43 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.858 -1.151 . . . . 1.5 109.111 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.685 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -60.76 159.07 11.58 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 107.244 -1.391 . . . . 0.47 107.244 179.573 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.677 ' H ' HD23 ' A' ' 22' ' ' LEU . 94.2 t -145.66 120.06 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.87 -1.144 . . . . 0.17 108.712 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.9 t -108.35 142.6 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 107.955 -1.128 . . . . 0.14 107.955 179.551 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.7 118.76 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.189 -0.944 . . . . 0.13 109.157 -179.273 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.555 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 31.8 t70 -97.33 120.31 37.45 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.36 -0.837 . . . . 1.05 109.852 179.082 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -96.7 24.06 6.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.237 -0.914 . . . . 0.73 110.024 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.8 m -57.48 141.94 45.87 Favored 'General case' 0 C--N 1.294 -1.812 0 O-C-N 121.233 -0.917 . . . . 0.3 110.55 -178.243 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.731 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -81.65 125.52 30.67 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.671 -1.233 . . . . 0.22 107.671 179.138 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.72 -33.34 74.7 Favored 'General case' 0 C--N 1.295 -1.796 0 C-N-CA 118.94 -1.104 . . . . 0.3 108.342 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.731 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.6 p-90 -70.48 -24.23 62.82 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.669 . . . . 0.26 110.902 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.93 123.11 29.62 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.565 -1.272 . . . . 0.26 107.565 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.462 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.58 -51.82 39.18 Favored Glycine 0 N--CA 1.489 2.179 0 C-N-CA 120.27 -0.967 . . . . 0.23 111.235 -178.087 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -53.44 -33.87 69.12 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 CA-C-N 118.524 1.162 . . . . 0.31 111.443 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.52 -53.98 7.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.471 -0.768 . . . . 0.24 110.166 -179.896 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -60.08 -36.94 78.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.061 -1.024 . . . . 1.59 109.76 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.498 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -60.15 -30.95 69.64 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.232 -0.917 . . . . 2.1 109.917 -179.11 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.587 HG22 ' O ' ' A' ' 38' ' ' ILE . 70.0 mt -81.38 -4.5 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.863 -0.523 . . . . 0.49 111.324 -179.335 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.1 ptmt -64.85 -28.79 3.05 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 120.558 -1.339 . . . . 0.8 113.567 -177.179 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.8 Cg_exo -55.62 -39.64 89.93 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 CA-C-N 121.952 1.733 . . . . 0.28 113.22 -176.316 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -68.14 -44.61 75.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.815 -1.554 . . . . 0.37 108.319 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.33 -54.82 41.06 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.409 -0.807 . . . . 0.16 110.405 178.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.7 t60 -67.65 -41.14 84.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.494 -0.754 . . . . 0.32 110.939 -179.727 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 64.1 m -62.14 -36.48 81.93 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.0 -1.063 . . . . 0.22 110.91 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -63.87 -19.37 65.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.214 -0.929 . . . . 0.22 110.04 -178.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -53.05 -39.53 63.32 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.91 -1.144 . . . . 0.16 107.91 -179.533 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 35.5 mp0 -82.96 -16.41 47.43 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.375 -0.828 . . . . 2.16 109.397 179.154 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -76.91 -39.0 52.39 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.513 -1.292 . . . . 1.78 107.513 179.166 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -123.7 67.81 1.03 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.3 -1.37 . . . . 0.25 107.3 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.2 p -62.89 -9.08 8.42 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.876 -0.787 . . . . 0.22 108.876 -179.467 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -90.13 6.91 40.52 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.288 -1.004 . . . . 1.13 108.288 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.502 HG13 ' HB3' ' A' ' 22' ' ' LEU . 55.2 t -125.05 145.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.041 -1.096 . . . . 0.24 108.041 179.42 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.5 mm -99.96 122.83 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 120.956 -1.09 . . . . 0.15 109.476 -178.549 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.603 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.7 m-85 -102.95 126.95 50.33 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.12 109.992 179.731 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.603 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -111.32 139.98 46.27 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.128 -0.983 . . . . 0.22 109.717 178.861 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -110.2 130.11 55.6 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 107.086 -1.45 . . . . 1.13 107.086 178.124 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.2 t -127.76 136.25 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.401 -0.812 . . . . 0.15 110.533 -177.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.605 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.6 t0 -98.69 120.34 38.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.363 -0.836 . . . . 1.05 108.95 179.507 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -66.74 -18.25 23.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 120.479 -1.388 . . . . 0.16 108.209 179.36 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 18.8 m-20 -93.8 -44.0 8.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.279 -0.888 . . . . 1.08 111.545 -179.097 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.4 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 25.8 m-20 -93.95 -13.49 27.01 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.537 -1.352 . . . . 1.07 108.423 179.586 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -125.24 38.38 4.19 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.578 -1.267 . . . . 0.14 107.578 179.518 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -59.9 -23.85 63.82 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.854 -0.528 . . . . 1.47 109.882 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.612 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -66.49 -38.26 86.87 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.034 -1.041 . . . . 1.05 108.984 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.612 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.2 t -69.95 -43.96 78.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.308 -0.87 . . . . 0.35 109.573 179.868 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 -36.33 64.0 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.449 -0.782 . . . . 0.26 111.235 -178.595 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.2 p -60.12 -37.73 80.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.773 -1.204 . . . . 0.24 109.428 -179.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.25 -38.13 89.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 2.06 109.526 179.327 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.448 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.44 -3.63 58.91 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.448 -0.782 . . . . 0.23 110.313 -178.907 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mp0 54.74 49.61 17.6 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.373 -0.829 . . . . 2.02 109.232 -179.584 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.77 132.21 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 120.846 -1.159 . . . . 0.16 108.576 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -103.48 -11.92 17.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.582 -0.699 . . . . 1.6 110.813 -178.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.517 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.97 156.26 24.53 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.751 -1.218 . . . . 0.14 110.596 -179.442 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -128.5 153.36 79.31 Favored Pre-proline 0 N--CA 1.497 1.888 0 N-CA-C 107.455 -1.313 . . . . 0.15 107.455 178.139 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -76.85 140.47 65.27 Favored 'Cis proline' 0 N--CA 1.488 1.205 0 C-N-CA 123.617 -1.409 . . . . 0.16 112.405 -2.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.517 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.0 m -124.91 132.64 53.27 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.934 -1.136 . . . . 0.13 107.934 177.475 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.555 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.0 m-85 -111.13 132.02 54.63 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.444 -0.947 . . . . 0.2 108.444 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.448 HE22 ' HB1' ' A' ' 69' ' ' ALA . 83.4 mt-30 -122.23 143.12 49.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.275 -0.89 . . . . 0.29 108.612 179.463 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 100' ' ' THR . 88.2 m-85 -109.12 132.68 53.89 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.525 0.679 . . . . 0.14 110.581 -178.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -127.53 147.29 50.32 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.473 0.654 . . . . 0.15 109.341 179.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -148.9 126.35 11.6 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.74 -1.207 . . . . 1.68 107.74 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.3 mttp 59.86 28.42 17.91 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.518 -0.739 . . . . 1.22 109.072 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.89 19.95 71.72 Favored Glycine 0 N--CA 1.489 2.198 0 O-C-N 121.101 -0.999 . . . . 0.23 111.095 179.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -130.46 145.13 51.78 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.045 -1.268 . . . . 2.07 109.94 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -79.87 126.86 31.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.287 -0.883 . . . . 1.82 109.636 179.663 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.6 m -121.63 6.04 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.737 -0.602 . . . . 0.3 110.126 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.81 157.03 21.09 Favored Glycine 0 N--CA 1.494 2.51 0 C-N-CA 118.716 -1.707 . . . . 0.17 111.454 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.453 ' OE2' ' CG2' ' A' ' 76' ' ' THR . 2.3 tp10 -164.95 147.46 8.22 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.518 -0.919 . . . . 1.93 108.518 179.367 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.46 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 4.3 p90 -169.4 155.87 6.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.665 -0.814 . . . . 0.14 109.213 177.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.4 p -126.17 162.77 24.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.688 -0.633 . . . . 0.12 110.024 -179.015 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.492 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.65 140.29 5.83 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.06 -1.616 . . . . 0.12 109.06 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.464 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.26 64.09 2.0 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.286 -1.126 . . . . 0.18 110.537 -179.296 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.3 t-20 -118.85 100.0 7.11 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.376 -0.972 . . . . 0.88 108.376 178.018 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.76 -30.12 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.328 -0.857 . . . . 1.06 111.641 -179.107 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -66.64 -29.85 69.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.875 -1.14 . . . . 1.61 109.76 -179.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 52.4 tttp -61.82 -33.92 75.01 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 109.043 -0.725 . . . . 1.45 109.043 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.48 -39.98 85.48 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.707 -0.849 . . . . 0.19 108.707 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.9 -43.96 97.38 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.232 -0.987 . . . . 2.1 110.854 -178.363 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.78 77.84 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.187 -0.946 . . . . 0.19 111.076 -178.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.4 HG21 ' CE1' ' A' ' 79' ' ' PHE . 19.6 m -64.74 -39.95 94.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.736 -1.228 . . . . 0.2 108.189 -179.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.429 ' O ' ' N ' ' A' ' 105' ' ' VAL . 74.1 mt -65.29 -47.13 88.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 107.671 -1.233 . . . . 0.16 107.671 178.397 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.479 ' O ' HG12 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -60.52 -35.47 76.06 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.657 -1.238 . . . . 0.95 107.657 179.562 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -69.98 -39.23 76.05 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 116.022 -0.535 . . . . 2.21 110.143 -179.33 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.685 ' HB2' HD11 ' A' ' 22' ' ' LEU . 84.6 mt -98.34 -4.45 34.92 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.061 -1.025 . . . . 0.25 111.398 -178.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.479 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.3 p . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.485 -1.385 . . . . 1.08 109.143 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm . . . . . 0 N--CA 1.5 2.029 0 N-CA-C 109.578 -0.527 . . . . 1.31 109.578 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.493 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 33.2 mm -130.42 142.49 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 121.855 -0.528 . . . . 0.15 109.721 -179.46 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 22.2 m -98.49 131.97 44.31 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 107.407 -1.331 . . . . 0.19 107.407 177.57 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.4 m -81.02 139.38 35.79 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.851 -1.155 . . . . 0.2 111.244 -178.2 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.451 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.9 m95 -77.19 -18.28 57.87 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.292 -0.88 . . . . 0.21 109.409 178.882 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.474 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.8 m120 . . . . . 0 N--CA 1.491 1.59 0 N-CA-C 108.123 -1.066 . . . . 0.49 108.123 179.354 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm . . . . . 0 N--CA 1.498 1.969 0 N-CA-C 109.205 -0.665 . . . . 1.67 109.205 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -93.37 125.16 37.82 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.742 -0.836 . . . . 0.31 108.742 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mm -99.86 113.59 35.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 N-CA-C 108.422 -0.955 . . . . 0.19 108.422 179.402 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -99.13 -1.04 40.42 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.116 -0.99 . . . . 2.25 109.915 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.3 p -155.38 154.51 32.09 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.108 -0.995 . . . . 0.15 110.999 -179.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 ttpp -61.49 -33.96 74.68 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.926 -1.138 . . . . 1.65 107.926 178.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 42.1 m -57.55 -44.12 84.95 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.32 -0.952 . . . . 0.23 108.555 -179.446 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.31 69.54 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.25 -0.906 . . . . 0.17 109.037 178.476 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.545 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.1 t80 -59.73 -43.2 94.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.257 -0.902 . . . . 0.14 109.028 -179.189 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -66.18 -40.52 90.53 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.688 -0.856 . . . . 1.31 108.688 179.467 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -64.64 -40.93 96.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.292 0.567 . . . . 1.77 110.562 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.9 -40.9 83.37 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.309 -0.869 . . . . 0.15 108.907 -178.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.545 HD11 ' CE2' ' A' ' 11' ' ' PHE . 58.0 mt -60.89 -40.03 91.5 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.343 -0.984 . . . . 0.17 108.343 179.197 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -69.99 -34.37 73.25 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.416 -0.803 . . . . 1.07 109.834 179.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.99 76.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.225 -0.922 . . . . 0.18 109.926 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.97 74.9 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 0.17 109.025 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.61 18.62 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.879 -1.288 . . . . 0.2 109.879 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -90.19 3.3 53.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.133 -1.216 . . . . 1.07 110.747 -179.053 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mtpt -77.06 149.99 35.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 1.5 109.51 -179.686 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.668 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.9 155.49 19.64 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.082 -1.081 . . . . 0.47 108.082 -179.39 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.668 ' H ' HD23 ' A' ' 22' ' ' LEU . 87.6 t -144.35 112.42 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.012 -1.055 . . . . 0.17 109.131 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -99.6 141.9 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.168 -1.049 . . . . 0.14 108.168 179.583 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.98 122.34 63.11 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.217 -0.927 . . . . 0.13 110.196 -178.542 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.471 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -99.24 122.94 43.09 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.646 -0.658 . . . . 1.05 109.775 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -99.26 18.54 17.33 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.264 -0.898 . . . . 0.73 109.925 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.5 m -52.05 147.87 6.82 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-O 122.063 0.935 . . . . 0.3 110.618 -178.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.803 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.76 123.9 31.66 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.444 -1.317 . . . . 0.22 107.444 178.743 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.77 -28.96 68.81 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.195 -1.002 . . . . 0.3 108.332 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.803 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 68.4 p-90 -78.02 -15.82 58.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.496 -0.753 . . . . 0.26 110.977 -179.515 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.7 t -88.22 116.55 26.5 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.877 -1.139 . . . . 0.26 108.04 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.42 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.37 -53.56 44.53 Favored Glycine 0 N--CA 1.489 2.193 0 C-N-CA 120.081 -1.057 . . . . 0.23 111.256 -178.521 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.99 -35.99 52.16 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.949 1.375 . . . . 0.31 111.612 179.895 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.92 -48.81 17.14 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.438 -0.789 . . . . 0.24 109.662 -179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.04 -37.81 80.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 1.59 109.47 179.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 33.0 tpp -59.12 -27.48 65.64 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.517 -0.74 . . . . 2.1 109.27 -179.393 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 38' ' ' ILE . 96.6 mt -80.94 -4.08 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.971 -0.456 . . . . 0.49 111.368 -179.772 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.536 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.08 5.83 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 120.283 -1.51 . . . . 0.8 113.916 -178.028 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.536 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 30.5 Cg_exo -58.89 -41.42 62.47 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 121.675 1.634 . . . . 0.28 112.379 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . 0.634 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 35.4 m-85 -69.13 -50.21 50.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.693 -1.255 . . . . 0.37 109.547 179.513 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -59.96 -50.82 72.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.027 -1.045 . . . . 0.16 109.447 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -67.54 -40.01 85.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.891 -0.506 . . . . 0.32 110.69 -179.423 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -63.29 -39.22 93.97 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.957 -1.089 . . . . 0.22 111.085 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.01 -23.43 63.67 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.194 -0.941 . . . . 0.22 110.203 -178.212 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.2 m -52.0 -40.15 60.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 118.72 -1.192 . . . . 0.16 108.765 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -82.82 -16.68 46.77 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.454 -0.779 . . . . 2.16 109.366 179.303 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -75.68 -37.44 59.55 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 107.362 -1.347 . . . . 1.78 107.362 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -124.75 68.71 1.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.077 -1.453 . . . . 0.25 107.077 177.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.4 p -62.28 -9.73 8.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.727 -0.842 . . . . 0.22 108.727 -179.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -91.92 9.84 31.29 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.644 -0.872 . . . . 1.13 108.644 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.8 t -127.58 144.82 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 107.639 -1.245 . . . . 0.24 107.639 178.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' CD1' ' A' ' 55' ' ' LEU . 27.2 mm -99.99 122.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.269 -0.895 . . . . 0.15 109.599 -178.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.471 ' C ' HD12 ' A' ' 55' ' ' LEU . 48.0 m-85 -103.06 126.81 50.41 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 108.692 -0.855 . . . . 0.12 108.692 179.25 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.471 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.0 mp -110.0 142.11 41.86 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.19 -0.944 . . . . 0.22 109.134 179.803 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -110.68 130.68 55.51 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 106.778 -1.564 . . . . 1.13 106.778 178.073 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.73 131.9 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.436 -0.79 . . . . 0.15 110.113 -178.333 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 45.6 t0 -96.1 119.89 35.4 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.518 -0.739 . . . . 1.05 109.599 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -67.98 -14.91 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.42 -1.425 . . . . 0.16 108.658 179.438 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.546 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 14.1 m-20 -94.45 -44.07 8.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.425 -0.797 . . . . 1.08 111.353 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -96.75 -18.63 19.49 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 120.776 -1.202 . . . . 1.07 108.836 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -119.03 36.59 4.4 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.346 -1.353 . . . . 0.14 107.346 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.579 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.4 OUTLIER -60.16 -23.55 64.03 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.961 -0.563 . . . . 1.47 110.277 -178.905 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.419 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -67.09 -35.43 79.77 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.001 -1.062 . . . . 1.05 108.633 179.5 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.419 HG23 ' OD1' ' A' ' 64' ' ' ASP . 5.6 t -73.36 -43.95 55.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.501 -0.749 . . . . 0.35 109.158 179.376 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.27 -40.77 74.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.393 -0.817 . . . . 0.26 110.957 -178.819 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.7 p -61.81 -32.71 73.04 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.71 -1.244 . . . . 0.24 109.287 -179.636 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -62.95 -38.16 89.97 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.282 -0.886 . . . . 2.06 109.075 179.344 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.54 2.04 55.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.558 -0.714 . . . . 0.23 111.081 -178.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 54.39 49.89 17.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.888 -1.133 . . . . 2.02 109.935 179.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.2 t -64.8 132.57 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 120.801 -1.187 . . . . 0.16 109.224 -179.114 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.95 -14.03 16.12 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.812 . . . . 1.6 110.056 -179.351 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.0 157.49 21.0 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.881 -1.137 . . . . 0.14 111.031 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -128.79 155.46 79.29 Favored Pre-proline 0 N--CA 1.499 1.99 0 N-CA-C 107.326 -1.361 . . . . 0.15 107.326 178.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -76.26 139.98 63.26 Favored 'Cis proline' 0 N--CA 1.49 1.288 0 C-N-CA 123.667 -1.389 . . . . 0.16 112.263 -2.178 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 99.1 m -124.56 139.53 53.79 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.491 -0.929 . . . . 0.13 108.491 178.038 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.471 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 95.4 m-85 -115.66 130.2 56.77 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.724 -0.843 . . . . 0.2 108.724 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -123.45 141.86 51.58 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.577 -0.897 . . . . 0.29 108.577 179.342 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 59.2 m-85 -108.37 137.25 46.65 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.528 0.68 . . . . 0.14 110.333 -179.229 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -129.91 147.31 51.66 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.377 0.608 . . . . 0.15 109.44 179.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -148.05 124.31 10.87 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.253 -1.388 . . . . 1.68 107.253 179.371 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 59.83 29.42 18.98 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.136 -1.061 . . . . 1.22 108.136 -178.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.4 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 76.59 15.23 81.72 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.611 -1.396 . . . . 0.23 109.611 -179.39 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.8 mm-40 -115.58 133.83 55.65 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.432 -1.04 . . . . 2.07 110.515 -179.222 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -78.68 124.38 28.13 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.27 -1.011 . . . . 1.82 108.27 178.217 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.7 m -123.93 9.14 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.558 -0.714 . . . . 0.3 110.968 -179.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.86 152.58 10.94 Favored Glycine 0 N--CA 1.498 2.816 0 C-N-CA 118.616 -1.754 . . . . 0.17 111.454 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -165.37 147.77 7.79 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.697 -0.884 . . . . 1.93 109.765 179.377 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -163.94 162.03 23.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 119.305 -0.958 . . . . 0.14 109.333 177.072 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -125.4 160.36 29.61 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.515 0.674 . . . . 0.12 109.551 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.493 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.03 141.02 5.95 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.907 -1.677 . . . . 0.12 108.907 179.747 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.426 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.15 66.31 2.28 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.256 -1.144 . . . . 0.18 109.168 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.81 92.17 3.72 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.413 -0.804 . . . . 0.88 109.073 179.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.634 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.5 OUTLIER -68.08 -32.17 72.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.081 -1.012 . . . . 1.06 111.422 -179.791 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -62.68 -30.13 71.17 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.81 -1.181 . . . . 1.61 109.075 -179.165 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -61.05 -35.66 77.53 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 109.115 -0.698 . . . . 1.45 109.115 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.68 -39.35 84.24 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-O 122.013 0.911 . . . . 0.19 108.892 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.09 -42.89 99.34 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.846 -0.742 . . . . 2.1 110.502 -177.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.97 -44.02 73.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.19 111.399 -178.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.9 m -66.3 -39.87 89.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.903 -1.123 . . . . 0.2 110.004 -178.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.68 -50.04 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.819 -1.178 . . . . 0.16 107.819 178.715 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.492 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.7 t-20 -60.01 -34.91 73.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.507 -0.923 . . . . 0.95 108.507 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -68.02 -40.04 83.02 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.581 -0.7 . . . . 2.21 110.368 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.666 ' HB2' HD11 ' A' ' 22' ' ' LEU . 92.2 mt -99.46 -2.03 37.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.32 -0.862 . . . . 0.25 111.451 -178.656 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 102' ' ' ASN . 7.7 p . . . . . 0 N--CA 1.498 1.965 0 O-C-N 120.568 -1.333 . . . . 1.08 109.298 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt . . . . . 0 N--CA 1.491 1.621 0 N-CA-C 109.614 -0.513 . . . . 1.31 109.614 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.493 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.2 mm -131.9 142.06 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.776 -0.577 . . . . 0.15 109.89 -179.101 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 17.9 m -99.7 125.26 45.54 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.937 -1.505 . . . . 0.19 106.937 177.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 69.5 m -77.99 140.89 39.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.897 -1.127 . . . . 0.2 110.386 -178.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.423 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.1 m95 -75.06 -10.13 59.18 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.183 -0.948 . . . . 0.21 109.252 179.785 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.489 1.491 0 O-C-N 121.334 -0.854 . . . . 0.49 108.862 179.784 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 tptm . . . . . 0 N--CA 1.497 1.891 0 N-CA-C 108.355 -0.98 . . . . 1.67 108.355 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -98.66 124.97 43.79 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.246 -0.909 . . . . 0.31 108.727 178.667 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.1 mm -103.38 113.28 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.551 -0.907 . . . . 0.19 108.551 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -98.26 0.0 44.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.316 -0.865 . . . . 2.25 110.04 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -151.63 155.42 38.35 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.042 -1.036 . . . . 0.15 111.217 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HZ2' ' HB3' ' A' ' 8' ' ' LYS . 9.8 ttpp -64.82 -31.87 73.3 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.491 -0.929 . . . . 1.65 108.491 178.321 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 93.5 m -57.44 -49.82 75.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.996 . . . . 0.23 109.465 -179.472 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.95 -29.58 67.84 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 119.416 -0.914 . . . . 0.17 108.863 179.015 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.487 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.1 t80 -59.78 -44.04 94.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.177 -0.952 . . . . 0.14 109.518 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -64.74 -43.08 94.5 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.542 -0.91 . . . . 1.31 108.542 -179.788 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.04 -37.5 87.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.762 -0.586 . . . . 1.77 110.171 179.468 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.48 -41.26 84.87 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.089 -1.007 . . . . 0.15 108.949 -179.089 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' A' ' 11' ' ' PHE . 82.4 mt -60.24 -39.85 88.17 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.188 -0.945 . . . . 0.17 108.828 179.239 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.55 -36.3 76.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.53 -0.731 . . . . 1.07 110.335 -179.555 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.39 -35.93 76.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.316 -0.865 . . . . 0.18 110.512 -178.725 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.35 -30.95 71.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.106 -0.996 . . . . 0.17 109.301 -179.697 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.22 -125.85 24.88 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.465 -1.454 . . . . 0.2 109.465 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -92.17 5.16 51.42 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.294 -1.121 . . . . 1.07 110.729 -179.304 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.69 148.88 40.16 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.79 -1.194 . . . . 1.5 108.947 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.69 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -59.82 159.82 8.42 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 106.638 -1.616 . . . . 0.47 106.638 -179.973 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.69 ' H ' HD23 ' A' ' 22' ' ' LEU . 78.8 t -147.35 111.06 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 120.75 -1.219 . . . . 0.17 108.937 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -101.34 144.16 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.255 -1.017 . . . . 0.14 108.255 179.526 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.2 t -126.66 121.66 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.333 -0.854 . . . . 0.13 109.52 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.7 t70 -99.28 119.94 38.74 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.284 -0.885 . . . . 1.05 110.051 179.499 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -95.52 21.96 7.62 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.145 -0.972 . . . . 0.73 109.645 178.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.81 147.86 18.05 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.818 -1.176 . . . . 0.3 110.305 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.501 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.56 126.59 34.58 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.174 -1.047 . . . . 0.22 108.174 179.422 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -67.91 -30.21 69.48 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.207 -0.997 . . . . 0.3 109.191 -179.462 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 59.2 p-90 -75.79 -18.06 59.64 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.076 -1.05 . . . . 0.26 110.15 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.0 t -83.8 121.64 27.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.979 -1.075 . . . . 0.26 108.402 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.39 -55.03 28.01 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 121.518 -0.739 . . . . 0.23 112.534 -178.005 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.8 Cg_endo -60.7 -29.93 89.35 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 119.412 1.606 . . . . 0.31 112.09 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.61 -49.76 20.41 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.118 -1.067 . . . . 0.24 108.118 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.37 -32.35 71.21 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.158 -1.053 . . . . 1.59 108.158 177.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -57.88 -28.04 63.82 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.007 -0.542 . . . . 2.1 110.112 -179.334 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.84 HD11 ' HB1' ' A' ' 92' ' ' ALA . 81.9 mt -85.25 -0.92 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.458 -0.776 . . . . 0.49 111.573 -178.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.74 -30.75 6.84 Favored Pre-proline 0 C--N 1.302 -1.497 0 O-C-N 120.263 -1.523 . . . . 0.8 113.045 -178.768 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.7 Cg_exo -59.7 -44.21 33.04 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 121.542 1.586 . . . . 0.28 112.91 -178.124 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -69.54 -45.38 68.93 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 118.36 -1.336 . . . . 0.37 108.948 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -61.31 -52.29 65.32 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.988 -1.07 . . . . 0.16 109.701 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -68.07 -42.49 80.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.536 -0.727 . . . . 0.32 111.548 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.1 m -62.74 -39.87 95.46 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.882 -1.136 . . . . 0.22 110.79 -179.202 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.5 mt -61.32 -23.78 65.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.331 -0.856 . . . . 0.22 110.755 -178.338 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.8 m -54.27 -35.32 62.41 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.094 -1.004 . . . . 0.16 109.009 -178.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -88.3 -13.0 41.92 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.082 -1.011 . . . . 2.16 108.734 179.183 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -80.52 -37.51 31.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.445 -1.317 . . . . 1.78 107.445 178.408 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -121.9 68.2 0.92 Allowed 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.986 -1.487 . . . . 0.25 106.986 178.138 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.1 p -64.01 -9.71 17.49 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 108.492 -0.929 . . . . 0.22 108.492 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -90.47 7.73 37.42 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.312 -0.996 . . . . 1.13 108.312 178.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.476 HG13 ' HB3' ' A' ' 22' ' ' LEU . 45.7 t -127.23 143.32 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 107.415 -1.328 . . . . 0.24 107.415 178.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.1 mm -99.78 124.13 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.097 -1.002 . . . . 0.15 109.501 -178.516 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.565 ' C ' HD12 ' A' ' 55' ' ' LEU . 40.0 m-85 -104.15 127.31 51.74 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.333 -0.855 . . . . 0.12 109.503 179.188 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.565 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.6 mp -110.42 139.86 45.21 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.3 -0.875 . . . . 0.22 109.218 178.239 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -110.06 130.34 55.55 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 106.982 -1.488 . . . . 1.13 106.982 178.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.4 t -128.28 134.04 65.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.354 -0.841 . . . . 0.15 110.74 -177.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.0 t0 -95.86 119.43 34.34 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.011 -0.737 . . . . 1.05 109.011 179.45 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.23 -16.38 20.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.476 -1.39 . . . . 0.16 108.39 179.223 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.85 -41.47 9.62 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 1.08 111.261 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 25.6 m-20 -95.74 -22.2 17.68 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.844 -1.16 . . . . 1.07 108.747 179.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -118.46 39.92 3.34 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.866 -1.161 . . . . 0.14 107.866 179.534 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -60.08 -22.1 62.31 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.785 -0.572 . . . . 1.47 110.059 -178.469 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.587 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.701 -1.249 . . . . 1.05 109.196 179.665 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.587 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.5 t -73.68 -43.99 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.05 -1.031 . . . . 0.35 109.395 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.91 75.77 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.26 110.477 -178.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.8 p -60.77 -33.45 72.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.011 -1.056 . . . . 0.24 109.129 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -62.07 -39.87 93.87 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.406 -0.809 . . . . 2.06 109.438 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.414 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -88.76 1.34 55.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.313 -0.867 . . . . 0.23 111.162 -178.318 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 55.07 49.64 17.08 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.253 -0.905 . . . . 2.02 109.034 -179.291 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.78 130.7 28.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.41 -1.33 . . . . 0.16 107.41 -179.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -102.88 -12.12 17.76 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.624 -0.673 . . . . 1.6 109.998 -178.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.45 156.3 20.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.845 -1.159 . . . . 0.14 111.26 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.489 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.4 p -124.6 154.62 69.97 Favored Pre-proline 0 N--CA 1.499 2.01 0 N-CA-C 108.133 -1.062 . . . . 0.15 108.133 178.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -77.32 145.52 80.59 Favored 'Cis proline' 0 N--CA 1.492 1.406 0 C-N-CA 123.542 -1.441 . . . . 0.16 112.359 -3.115 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.41 131.1 48.47 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 108.564 -0.902 . . . . 0.13 108.564 178.125 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.799 ' CD1' HD21 ' A' ' 97' ' ' LEU . 89.8 m-85 -109.84 130.16 55.56 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.631 -0.668 . . . . 0.2 109.455 -179.207 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.414 HE22 ' CB ' ' A' ' 69' ' ' ALA . 72.2 mt-30 -120.63 140.45 51.54 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.41 -0.807 . . . . 0.29 109.04 179.104 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.9 131.97 53.95 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 121.117 0.484 . . . . 0.14 110.077 -179.341 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -124.84 145.83 49.58 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.492 0.663 . . . . 0.15 109.432 179.439 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -146.27 127.35 14.65 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.325 -1.361 . . . . 1.68 107.325 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.1 mttt 54.95 33.25 19.69 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.319 -0.863 . . . . 1.22 110.072 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.9 21.5 76.29 Favored Glycine 0 N--CA 1.491 2.312 0 O-C-N 120.913 -1.117 . . . . 0.23 110.921 178.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -131.02 141.51 50.23 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.209 -1.171 . . . . 2.07 109.786 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -77.67 126.84 31.49 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.98 -1.075 . . . . 1.82 109.51 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.0 m -122.25 12.1 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.766 -0.584 . . . . 0.3 110.187 -179.472 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.33 152.04 10.72 Favored Glycine 0 N--CA 1.493 2.447 0 C-N-CA 118.681 -1.723 . . . . 0.17 111.268 179.645 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.5 tp10 -163.04 137.49 6.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.819 -0.812 . . . . 1.93 109.451 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.483 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.2 p90 -163.37 158.82 21.68 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.591 -0.844 . . . . 0.14 109.976 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -125.97 161.66 27.0 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-O 121.326 0.584 . . . . 0.12 109.792 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.455 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.6 141.71 5.89 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.639 -1.384 . . . . 0.12 109.639 179.36 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.84 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.59 67.28 5.3 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.134 -1.216 . . . . 0.18 109.669 -179.932 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 99.01 6.36 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 108.684 -0.858 . . . . 0.88 108.684 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -35.03 75.26 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.157 -0.964 . . . . 1.06 111.479 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -64.13 -30.04 71.12 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.992 -1.067 . . . . 1.61 109.657 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.96 -37.4 82.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.693 -0.63 . . . . 1.45 109.612 -179.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.799 HD21 ' CD1' ' A' ' 77' ' ' PHE . 47.3 mt -58.77 -38.49 78.6 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.438 -0.949 . . . . 0.19 108.438 179.672 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -63.99 -40.68 96.91 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 120.252 -0.579 . . . . 2.1 110.748 -178.444 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.09 -43.92 73.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.082 -1.011 . . . . 0.19 111.651 -178.567 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.29 -40.01 93.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.759 -1.213 . . . . 0.2 109.923 -178.777 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.36 -51.63 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.255 -0.903 . . . . 0.16 108.982 -179.733 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.3 t30 -60.33 -34.24 73.54 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.334 -0.988 . . . . 0.95 108.334 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -68.05 -39.91 82.91 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.611 -0.681 . . . . 2.21 110.426 -178.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.561 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.8 mt -99.58 -1.98 36.82 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.284 -0.885 . . . . 0.25 110.971 -178.666 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.667 -1.271 . . . . 1.08 109.3 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt . . . . . 0 N--CA 1.489 1.503 0 N-CA-C 108.963 -0.754 . . . . 1.31 108.963 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.455 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.6 mm -128.41 140.34 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.558 -0.534 . . . . 0.15 109.558 -179.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.5 m -100.58 124.63 46.42 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 107.102 -1.444 . . . . 0.19 107.102 178.002 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -75.51 140.04 42.55 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.94 -1.1 . . . . 0.2 111.468 -177.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.489 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.8 m95 -75.42 -10.23 59.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.21 108.807 178.779 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 . . . . . 0 N--CA 1.492 1.661 0 N-CA-C 108.582 -0.895 . . . . 0.49 108.582 179.319 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 28.0 tptp . . . . . 0 N--CA 1.497 1.919 0 N-CA-C 108.521 -0.918 . . . . 1.67 108.521 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -98.6 124.14 43.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.493 -0.755 . . . . 0.31 109.429 179.784 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.26 113.98 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 108.329 -0.989 . . . . 0.19 108.329 178.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -98.65 -0.52 42.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 2.25 109.689 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -155.25 157.89 37.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.057 -1.027 . . . . 0.15 110.948 179.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -65.16 -30.96 71.92 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.777 -1.194 . . . . 1.65 107.777 178.43 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.8 m -58.98 -47.36 85.44 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.327 -0.858 . . . . 0.23 108.941 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.1 -29.76 68.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.697 -0.853 . . . . 0.17 108.697 178.702 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.527 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.0 t80 -59.72 -44.78 93.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.227 -0.92 . . . . 0.14 109.259 -179.683 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -64.27 -43.65 94.19 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 121.809 0.814 . . . . 1.31 108.992 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.17 -37.36 87.12 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.341 0.591 . . . . 1.77 110.804 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.74 82.88 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.34 -0.85 . . . . 0.15 108.891 -179.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.527 HD11 ' CE2' ' A' ' 11' ' ' PHE . 63.3 mt -60.55 -40.2 90.71 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.352 -0.843 . . . . 0.17 108.791 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.26 -32.53 70.39 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.379 -0.825 . . . . 1.07 109.829 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.44 79.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.298 -0.876 . . . . 0.18 109.768 -179.078 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.83 76.36 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.17 109.317 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.89 -123.92 16.3 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.963 -1.255 . . . . 0.2 109.963 -179.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.42 2.3 54.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.971 -1.311 . . . . 1.07 110.589 -178.876 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -74.45 148.45 41.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.84 -1.162 . . . . 1.5 109.169 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.693 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -60.37 159.4 10.22 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.773 -1.566 . . . . 0.47 106.773 179.708 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.693 ' H ' HD23 ' A' ' 22' ' ' LEU . 88.7 t -146.93 113.49 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 120.78 -1.2 . . . . 0.17 108.983 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -101.35 141.75 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 107.964 -1.125 . . . . 0.14 107.964 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.0 t -124.58 120.62 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.397 -0.814 . . . . 0.13 109.377 -179.226 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.7 t70 -99.47 118.66 36.56 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.418 -0.801 . . . . 1.05 110.447 179.595 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -95.06 24.15 5.1 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.513 -0.742 . . . . 0.73 109.735 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.405 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.4 m -59.0 145.12 43.01 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.993 -1.067 . . . . 0.3 109.671 -178.835 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.734 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.33 124.04 31.5 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.462 -1.31 . . . . 0.22 107.462 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -67.84 -31.79 71.87 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.102 -1.073 . . . . 0.3 108.102 179.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.734 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.0 p-90 -70.54 -23.04 62.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.745 -0.597 . . . . 0.26 110.584 179.629 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -83.95 116.46 22.81 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.333 -1.358 . . . . 0.26 107.333 179.54 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.54 -50.83 63.55 Favored Glycine 0 N--CA 1.49 2.294 0 C-N-CA 120.514 -0.851 . . . . 0.23 111.503 -177.692 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.8 Cg_exo -54.56 -35.02 84.9 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 CA-C-N 118.518 1.159 . . . . 0.31 112.052 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.69 -47.85 16.14 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.835 . . . . 0.24 109.642 -179.83 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -60.12 -33.13 71.71 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.193 -1.04 . . . . 1.59 108.193 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.9 tpt -59.78 -30.17 68.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.837 -0.539 . . . . 2.1 109.725 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.557 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.5 mt -83.87 -2.04 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.705 -0.622 . . . . 0.49 110.88 -178.603 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.72 -30.81 7.56 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 120.423 -1.423 . . . . 0.8 113.028 -178.561 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 24.4 Cg_exo -59.93 -42.17 47.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 CA-C-N 121.641 1.622 . . . . 0.28 112.826 -177.549 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -68.52 -45.98 70.79 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 118.628 -1.229 . . . . 0.37 108.767 -179.78 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -63.12 -51.97 64.4 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.977 -1.077 . . . . 0.16 109.572 179.002 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -67.46 -40.1 85.35 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.707 -0.62 . . . . 0.32 111.106 -179.444 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.8 m -63.88 -36.29 83.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.878 -1.139 . . . . 0.22 110.752 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.56 -20.82 65.95 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.212 -0.93 . . . . 0.22 110.656 -177.887 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.1 m -54.93 -36.46 65.29 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.917 -1.114 . . . . 0.16 108.632 -179.648 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.7 mp0 -88.18 -15.95 34.65 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.131 -0.98 . . . . 2.16 109.9 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -79.3 -37.42 37.76 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 107.169 -1.419 . . . . 1.78 107.169 179.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . 0.405 ' C ' ' H ' ' A' ' 51' ' ' ASN . 77.6 m-85 -123.77 67.01 1.03 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 107.374 -1.343 . . . . 0.25 107.374 178.169 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.6 p -63.35 -5.72 3.86 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.14 -1.059 . . . . 0.22 108.14 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.405 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.7 t-20 -79.99 -20.41 45.54 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.223 -0.658 . . . . 1.13 109.223 178.647 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 22' ' ' LEU . 60.8 t -107.01 149.46 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 108.774 -0.824 . . . . 0.24 108.774 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.8 mm -99.79 120.0 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.258 -0.901 . . . . 0.15 108.678 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.604 ' C ' HD12 ' A' ' 55' ' ' LEU . 44.2 m-85 -99.63 126.15 45.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.238 -0.914 . . . . 0.12 110.221 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.604 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -111.49 141.59 44.86 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.225 -0.922 . . . . 0.22 109.35 178.78 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -109.23 132.1 54.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 106.853 -1.536 . . . . 1.13 106.853 178.338 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.0 t -127.89 131.09 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.448 -0.782 . . . . 0.15 109.858 -178.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.685 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.5 t0 -94.27 120.31 34.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.436 -0.79 . . . . 1.05 108.898 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.0 m -67.46 -19.52 25.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 120.627 -1.296 . . . . 0.16 108.329 179.203 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.53 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 17.6 m-20 -92.03 -45.04 8.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.509 -0.744 . . . . 1.08 111.726 -179.271 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.448 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 18.1 m-20 -93.97 -13.59 26.87 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.566 -1.334 . . . . 1.07 108.195 179.553 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 36.98 4.51 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.734 -1.21 . . . . 0.14 107.734 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -60.03 -24.43 64.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.687 -0.633 . . . . 1.47 109.645 -178.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.538 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -66.67 -38.61 87.17 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.875 -1.141 . . . . 1.05 108.33 178.793 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.538 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.8 t -69.23 -44.54 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.395 -0.816 . . . . 0.35 109.626 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.56 -37.22 68.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.371 -0.831 . . . . 0.26 110.726 -178.664 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -60.24 -37.41 80.27 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.165 -0.959 . . . . 0.24 109.753 -178.785 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.07 -38.68 92.16 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.342 -0.849 . . . . 2.06 109.26 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.408 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.74 -1.46 56.28 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.47 -0.769 . . . . 0.23 111.014 -178.816 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 53.84 48.29 21.66 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.027 -1.046 . . . . 2.02 109.596 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.8 t -63.22 134.37 28.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 C-N-CA 118.787 -1.165 . . . . 0.16 108.142 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -106.92 -12.3 15.5 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.563 -0.71 . . . . 1.6 109.797 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.471 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 154.53 19.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 0.14 110.911 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -127.62 154.5 77.69 Favored Pre-proline 0 N--CA 1.496 1.864 0 N-CA-C 107.726 -1.212 . . . . 0.15 107.726 178.611 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.6 143.25 73.75 Favored 'Cis proline' 0 N--CA 1.489 1.248 0 C-N-CA 123.57 -1.429 . . . . 0.16 112.569 -2.183 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.5 m -128.37 133.84 48.72 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.869 -0.789 . . . . 0.13 108.869 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.519 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.1 m-85 -110.71 131.02 55.41 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.632 -0.877 . . . . 0.2 108.632 -179.413 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.408 HE22 ' HB1' ' A' ' 69' ' ' ALA . 72.3 mt-30 -122.47 140.19 53.02 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.533 -0.914 . . . . 0.29 108.533 179.429 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -106.63 132.94 52.05 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.377 0.608 . . . . 0.14 109.931 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -126.87 145.68 50.57 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 109.013 -0.736 . . . . 0.15 109.013 179.248 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -145.86 129.41 16.99 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 106.938 -1.505 . . . . 1.68 106.938 179.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.4 mttt 56.55 27.96 13.15 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.241 -0.912 . . . . 1.22 108.594 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.94 25.02 67.83 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.689 -1.364 . . . . 0.23 109.689 -179.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.411 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.4 mm100 -128.69 136.18 50.26 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.394 -1.062 . . . . 2.07 110.362 -179.82 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -79.38 128.15 32.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.236 -0.915 . . . . 1.82 109.654 179.461 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.4 m -123.93 3.98 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.76 -0.587 . . . . 0.3 110.377 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.22 155.89 17.1 Favored Glycine 0 N--CA 1.496 2.639 0 C-N-CA 118.648 -1.739 . . . . 0.17 111.506 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -164.04 148.7 10.21 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.865 -0.785 . . . . 1.93 109.482 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 6.3 p90 -164.37 157.33 17.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.613 -0.835 . . . . 0.14 109.913 178.218 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.2 p -125.8 160.41 29.89 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.391 0.615 . . . . 0.12 109.673 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.481 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.01 141.7 5.84 Favored Glycine 0 N--CA 1.487 2.052 0 N-CA-C 109.125 -1.59 . . . . 0.12 109.125 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.457 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.01 65.76 2.1 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.378 -1.072 . . . . 0.18 109.57 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 96.98 5.39 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.217 -0.927 . . . . 0.88 108.567 179.062 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -31.95 70.25 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.12 -0.988 . . . . 1.06 111.722 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.28 -29.85 70.93 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.793 -1.192 . . . . 1.61 108.914 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.04 -35.73 77.68 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.705 -0.622 . . . . 1.45 109.403 -179.434 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 56.3 mt -59.88 -39.86 86.76 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.136 0.97 . . . . 0.19 108.508 179.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -61.99 -43.76 98.16 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.755 -0.657 . . . . 2.1 111.087 -177.677 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.93 -44.1 73.74 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.035 -1.041 . . . . 0.19 111.659 -178.323 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -66.13 -40.2 90.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.87 -1.144 . . . . 0.2 110.165 -178.444 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.36 -50.11 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.036 -1.04 . . . . 0.16 108.548 179.351 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.461 ' O ' HG12 ' A' ' 105' ' ' VAL . 24.9 t-20 -59.94 -36.39 76.95 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.905 0.86 . . . . 0.95 108.846 179.209 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -67.72 -39.9 84.28 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.812 -0.555 . . . . 2.21 109.846 -178.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.687 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.8 mt -97.56 -4.53 37.58 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.152 -0.968 . . . . 0.25 111.267 -179.201 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.461 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.0 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 120.411 -1.431 . . . . 1.08 109.285 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.2 mmtm . . . . . 0 N--CA 1.486 1.369 0 N-CA-C 109.129 -0.693 . . . . 1.31 109.129 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.481 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.1 mm -130.04 140.27 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 122.045 -0.409 . . . . 0.15 110.232 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 27.8 m -98.9 130.54 45.3 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 177.497 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.1 m -81.25 144.79 31.31 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.721 -1.237 . . . . 0.2 110.875 -178.189 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.471 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.0 m95 -79.72 -15.49 57.42 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.236 -0.915 . . . . 0.21 109.53 178.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 C--N 1.303 -1.442 0 N-CA-C 107.465 -1.309 . . . . 0.49 107.465 179.126 . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.1 tttp . . . . . 0 N--CA 1.496 1.854 0 N-CA-C 109.037 -0.727 . . . . 1.67 109.037 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -96.56 125.45 41.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.403 -0.811 . . . . 0.31 109.075 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 45.3 mm -100.32 111.26 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 N-CA-C 108.517 -0.92 . . . . 0.19 108.517 179.348 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 54.1 mp0 -98.88 -1.16 40.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.176 -0.952 . . . . 2.25 108.613 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -155.17 156.91 36.55 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.366 -0.834 . . . . 0.15 110.378 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.467 ' HZ1' ' HB2' ' A' ' 68' ' ' GLU . 15.4 ttmm -62.92 -33.37 75.2 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.195 -1.039 . . . . 1.65 108.195 178.509 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.0 m -53.59 -49.51 67.63 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.524 -0.87 . . . . 0.23 109.213 -178.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -30.48 69.37 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.334 -0.854 . . . . 0.17 109.165 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.526 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.0 t80 -58.49 -45.28 89.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.897 -1.127 . . . . 0.14 108.927 -179.478 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -64.88 -41.78 95.36 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.484 -0.76 . . . . 1.31 109.134 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.73 -39.72 94.12 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 1.77 110.819 -179.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.59 82.08 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.044 -1.035 . . . . 0.15 109.016 -179.31 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.526 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.6 mt -60.22 -41.71 93.65 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.938 -1.134 . . . . 0.17 107.938 179.165 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.49 -37.02 77.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.572 -0.705 . . . . 1.07 110.273 179.813 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.24 -39.64 82.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 0.18 110.429 -179.203 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.23 -27.91 69.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.91 . . . . 0.17 108.952 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.04 -126.36 28.78 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.625 -1.39 . . . . 0.2 109.625 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -90.69 4.52 51.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.118 -1.225 . . . . 1.07 110.059 -179.192 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . 0.413 ' HZ2' ' HG2' ' A' ' 21' ' ' LYS . 26.7 mtpp -74.75 150.52 39.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.873 -1.142 . . . . 1.5 109.079 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.653 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -59.62 159.5 8.41 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.511 -1.292 . . . . 0.47 107.511 -179.253 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.653 ' H ' HD23 ' A' ' 22' ' ' LEU . 61.8 t -147.25 116.89 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 120.993 -1.067 . . . . 0.17 108.3 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.31 144.01 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.211 -1.033 . . . . 0.14 108.211 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.4 t -125.24 123.78 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.38 -0.825 . . . . 0.13 109.938 -179.322 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -100.98 120.16 39.77 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.28 -0.888 . . . . 1.05 110.075 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -95.87 22.41 7.41 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.925 -1.109 . . . . 0.73 110.107 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -58.12 149.0 24.81 Favored 'General case' 0 C--N 1.296 -1.745 0 O-C-N 120.969 -1.082 . . . . 0.3 110.494 -178.057 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.596 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.59 124.18 31.85 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.963 -1.125 . . . . 0.22 107.963 179.389 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -65.18 -32.07 73.57 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 118.78 -1.168 . . . . 0.3 108.21 -179.795 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.596 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 51.9 p-90 -72.38 -24.37 61.25 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.326 -0.859 . . . . 0.26 111.495 179.672 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -82.8 116.65 22.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.584 -1.322 . . . . 0.26 109.304 -178.741 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.442 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.12 -51.98 54.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 111.267 -0.733 . . . . 0.23 111.267 -178.753 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.6 Cg_exo -50.98 -34.97 48.5 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 CA-C-N 118.776 1.288 . . . . 0.31 111.673 179.518 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.8 -47.45 15.17 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.39 -0.818 . . . . 0.24 109.637 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.74 -33.14 71.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.06 -1.025 . . . . 1.59 108.863 179.141 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 23.5 ttt -58.34 -26.21 62.84 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.516 -0.74 . . . . 2.1 109.969 179.366 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.489 HG22 ' O ' ' A' ' 38' ' ' ILE . 43.7 mt -86.27 -2.36 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.406 -0.809 . . . . 0.49 111.14 -178.705 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.553 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -63.38 -30.56 5.51 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 120.187 -1.571 . . . . 0.8 113.298 -177.533 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 29.3 Cg_exo -60.15 -41.27 53.03 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 CA-C-N 121.492 1.569 . . . . 0.28 112.375 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -68.63 -48.52 63.86 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.797 -1.189 . . . . 0.37 109.534 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -60.91 -51.94 67.14 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.154 -0.967 . . . . 0.16 109.151 179.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -65.72 -43.31 89.48 Favored 'General case' 0 C--N 1.292 -1.892 0 O-C-N 121.691 -0.63 . . . . 0.32 110.747 179.634 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.5 m -62.77 -39.49 94.35 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.829 -1.169 . . . . 0.22 111.392 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.7 -20.06 63.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.97 -1.082 . . . . 0.22 110.159 -178.201 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.5 m -53.98 -39.71 66.26 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.974 -1.09 . . . . 0.16 108.284 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -83.07 -18.16 40.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.044 -1.035 . . . . 2.16 109.867 178.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -76.85 -35.69 57.34 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.244 -1.391 . . . . 1.78 107.244 179.597 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -123.8 67.11 1.03 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.405 -1.332 . . . . 0.25 107.405 178.183 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.3 p -64.28 -10.42 23.78 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 108.868 -0.79 . . . . 0.22 108.868 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -90.23 8.45 33.09 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.04 -1.096 . . . . 1.13 108.04 179.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 22' ' ' LEU . 40.3 t -127.16 143.65 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 107.483 -1.303 . . . . 0.24 107.483 178.598 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.405 HG22 ' CD1' ' A' ' 55' ' ' LEU . 27.7 mm -98.99 121.22 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.222 -0.924 . . . . 0.15 109.614 -178.375 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.447 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.3 m-85 -99.15 127.88 45.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.12 109.403 179.392 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.447 HD12 ' C ' ' A' ' 54' ' ' PHE . 2.8 mp -111.7 146.36 37.65 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.349 -0.845 . . . . 0.22 109.333 178.903 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -116.04 129.83 56.54 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.775 -1.565 . . . . 1.13 106.775 177.778 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.8 t -126.79 132.78 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 CA-C-O 121.547 0.689 . . . . 0.15 109.827 -178.359 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 53.7 t0 -97.98 118.92 35.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.535 -0.913 . . . . 1.05 108.535 179.626 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.2 m -65.57 -20.87 28.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 120.252 -1.53 . . . . 0.16 108.247 179.292 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.524 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 3.4 m-20 -92.14 -41.51 10.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.517 -0.739 . . . . 1.08 112.406 -177.982 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.424 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 65.6 m-20 -95.49 -20.98 18.61 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.402 -1.436 . . . . 1.07 108.437 179.223 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.98 43.42 2.79 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 108.238 -1.023 . . . . 0.14 108.238 179.258 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -61.56 -19.3 62.01 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.615 -0.678 . . . . 1.47 109.645 -179.144 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.651 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -62.8 -40.47 97.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.105 -0.997 . . . . 1.05 109.583 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.651 HG23 ' OD1' ' A' ' 64' ' ' ASP . 22.2 t -72.31 -43.45 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.244 -0.91 . . . . 0.35 109.69 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.49 -39.16 74.33 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.647 -0.658 . . . . 0.26 111.371 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -61.21 -36.0 78.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.983 -1.073 . . . . 0.24 109.191 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.467 ' HB2' ' HZ1' ' A' ' 8' ' ' LYS . 14.1 tm-20 -64.97 -39.67 93.84 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.527 -0.733 . . . . 2.06 109.24 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.15 -3.2 58.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.23 110.791 -178.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 55.51 50.31 14.88 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.002 -1.062 . . . . 2.02 109.746 -179.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.62 134.03 28.91 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 C-N-CA 118.627 -1.229 . . . . 0.16 108.63 -179.049 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -105.0 -12.72 16.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.67 -0.644 . . . . 1.6 110.23 -179.197 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.466 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 155.55 20.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.908 -1.12 . . . . 0.14 110.92 179.526 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.423 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.1 p -128.91 154.45 80.2 Favored Pre-proline 0 N--CA 1.499 1.983 0 N-CA-C 107.455 -1.313 . . . . 0.15 107.455 178.582 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -76.91 143.17 74.92 Favored 'Cis proline' 0 N--CA 1.492 1.43 0 C-N-CA 123.985 -1.256 . . . . 0.16 112.854 -1.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.0 m -130.0 134.75 47.63 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.044 -0.724 . . . . 0.13 109.044 178.55 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -110.58 130.16 55.63 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.378 0.608 . . . . 0.2 109.777 -179.385 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -120.98 139.94 52.58 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 108.189 -1.041 . . . . 0.29 108.189 179.29 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -105.84 134.97 48.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.669 -0.644 . . . . 0.14 110.126 -178.94 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -129.45 145.85 51.37 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.709 0.766 . . . . 0.15 109.577 179.266 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -149.09 131.18 15.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.372 -1.714 . . . . 1.68 106.372 179.072 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.6 mttt 57.33 30.08 17.92 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.186 -0.946 . . . . 1.22 109.575 -178.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.56 18.31 79.84 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.451 -1.06 . . . . 0.23 110.451 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -127.52 142.88 51.27 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.388 -1.066 . . . . 2.07 109.654 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -80.06 131.55 35.79 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.432 -0.792 . . . . 1.82 109.324 179.572 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.1 m -121.8 11.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.814 -0.554 . . . . 0.3 110.374 -179.638 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 167.49 161.54 17.18 Favored Glycine 0 N--CA 1.498 2.805 0 C-N-CA 118.42 -1.848 . . . . 0.17 112.012 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -165.32 149.23 8.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.872 -0.781 . . . . 1.93 110.198 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 12.1 p90 -162.84 160.59 25.3 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.078 -1.014 . . . . 0.14 109.135 177.876 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.29 164.9 20.0 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 121.492 0.663 . . . . 0.12 109.932 -178.914 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.483 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.74 142.38 6.68 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.072 -1.611 . . . . 0.12 109.072 179.862 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.409 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -78.78 62.96 3.41 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.272 -1.134 . . . . 0.18 109.495 -179.82 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.72 97.37 5.94 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.475 -0.766 . . . . 0.88 109.015 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -32.66 72.4 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.332 -0.855 . . . . 1.06 111.265 -179.704 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.87 -30.04 71.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.044 -1.035 . . . . 1.61 109.934 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -61.23 -35.95 78.64 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.626 0.727 . . . . 1.45 109.206 -179.1 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.9 mt -59.52 -39.43 83.84 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 122.253 1.025 . . . . 0.19 108.968 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -62.43 -43.07 99.69 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 119.824 -0.75 . . . . 2.1 110.745 -177.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.15 69.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.951 -1.093 . . . . 0.19 111.031 -178.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.3 m -63.97 -40.16 95.77 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 0.2 109.874 -178.714 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.7 mt -61.29 -50.02 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 N-CA-C 107.849 -1.167 . . . . 0.16 107.849 178.784 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.471 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.2 t-20 -60.26 -35.08 74.68 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.693 -0.855 . . . . 0.95 108.693 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -67.65 -38.57 84.0 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.418 -0.801 . . . . 2.21 109.881 -178.639 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HB2' HD11 ' A' ' 22' ' ' LEU . 84.0 mt -99.21 -4.16 32.68 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.065 -1.022 . . . . 0.25 111.405 -179.463 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.471 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.496 1.868 0 O-C-N 120.538 -1.351 . . . . 1.08 109.164 -179.177 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.7 mmtt . . . . . 0 N--CA 1.49 1.567 0 N-CA-C 109.536 -0.542 . . . . 1.31 109.536 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.483 HD11 ' HA2' ' A' ' 91' ' ' GLY . 35.3 mm -130.28 139.88 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.856 -0.528 . . . . 0.15 110.404 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.6 m -98.17 125.38 43.17 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 107.524 -1.287 . . . . 0.19 107.524 177.334 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -77.93 145.07 36.34 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.831 -1.168 . . . . 0.2 111.689 -178.348 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.466 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.6 m95 -76.7 -12.02 59.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.805 . . . . 0.21 108.976 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 . . . . . 0 N--CA 1.491 1.622 0 O-C-N 121.031 -1.043 . . . . 0.49 108.485 179.654 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm . . . . . 0 N--CA 1.5 2.028 0 N-CA-C 108.889 -0.782 . . . . 1.67 108.889 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -95.96 124.22 39.88 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.888 -1.132 . . . . 0.31 108.595 178.74 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.4 mm -102.0 112.03 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.341 -0.849 . . . . 0.19 109.329 179.57 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.48 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.1 mp0 -97.21 -1.0 45.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.946 . . . . 2.25 109.372 179.836 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -154.87 157.62 38.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.59 -1.319 . . . . 0.15 111.208 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.419 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 34.4 ttmt -63.88 -32.48 74.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.017 -1.105 . . . . 1.65 108.017 177.648 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.4 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 52.1 m -56.28 -46.43 79.74 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.319 -0.952 . . . . 0.23 108.841 -178.82 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.59 -30.25 66.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.256 -0.902 . . . . 0.17 109.166 178.745 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.51 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.8 t80 -59.86 -43.81 94.47 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.397 -0.815 . . . . 0.14 108.974 -179.025 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -65.55 -42.96 91.31 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.693 0.759 . . . . 1.31 109.819 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -66.52 -39.7 88.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.556 -0.715 . . . . 1.77 110.06 179.638 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.9 96.26 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.304 -0.872 . . . . 0.15 108.696 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.51 HD11 ' CE2' ' A' ' 11' ' ' PHE . 65.4 mt -59.92 -40.25 88.23 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.219 -0.926 . . . . 0.17 108.597 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -69.39 -36.33 76.68 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.181 -0.95 . . . . 1.07 110.009 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.6 -39.31 84.8 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.343 -0.848 . . . . 0.18 110.516 -178.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -32.45 70.96 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.228 -0.92 . . . . 0.17 108.966 -179.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.55 -124.02 17.59 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.968 -1.253 . . . . 0.2 109.968 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -93.43 5.31 52.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.32 -1.106 . . . . 1.07 110.505 -179.073 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -76.55 149.28 36.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.157 -0.964 . . . . 1.5 109.173 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.682 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -60.31 157.73 13.05 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 106.861 -1.533 . . . . 0.47 106.861 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.663 ' H ' HD23 ' A' ' 22' ' ' LEU . 99.5 t -143.95 112.39 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.049 -1.032 . . . . 0.17 108.685 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -100.17 144.68 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 108.443 -0.947 . . . . 0.14 108.443 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.416 ' CG1' HG21 ' A' ' 57' ' ' VAL . 21.4 t -126.4 121.09 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 O-C-N 121.273 -0.892 . . . . 0.13 109.796 -179.917 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.0 t70 -98.66 120.08 38.49 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.217 -0.927 . . . . 1.05 109.872 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -96.3 23.27 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.342 -0.849 . . . . 0.73 110.059 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.469 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.3 m -58.67 147.36 33.06 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.054 -1.029 . . . . 0.3 110.746 -178.788 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.555 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.76 125.57 32.68 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 107.94 -1.133 . . . . 0.22 107.94 178.669 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . 0.401 HG22 ' OD1' ' A' ' 58' ' ' ASP . 8.9 t -67.98 -33.91 75.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 118.957 -1.097 . . . . 0.3 108.573 -179.887 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.555 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.0 p-90 -70.42 -23.93 62.83 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.322 -0.861 . . . . 0.26 110.387 179.396 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.46 119.83 24.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.599 -1.313 . . . . 0.26 107.486 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -64.7 -51.29 53.09 Favored Glycine 0 N--CA 1.49 2.243 0 C-N-CA 120.3 -0.952 . . . . 0.23 110.737 -178.152 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -51.8 -36.34 62.23 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 118.553 1.176 . . . . 0.31 112.504 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.469 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.46 -48.86 16.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.97 . . . . 0.24 109.883 179.918 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.6 -34.91 74.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.119 -0.988 . . . . 1.59 109.465 179.309 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -60.01 -28.95 68.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.568 -0.708 . . . . 2.1 109.955 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.547 HG22 ' O ' ' A' ' 38' ' ' ILE . 68.2 mt -83.31 -0.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.753 -0.592 . . . . 0.49 110.379 -178.939 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.66 -30.26 6.22 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 120.674 -1.266 . . . . 0.8 113.051 -179.047 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.9 Cg_exo -59.76 -42.9 41.95 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 CA-C-N 121.699 1.643 . . . . 0.28 113.333 -177.507 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -67.91 -47.87 67.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.432 -1.417 . . . . 0.37 108.561 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -59.84 -51.53 69.32 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.296 -0.878 . . . . 0.16 110.104 179.174 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -69.37 -44.42 71.57 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 121.801 -0.562 . . . . 0.32 111.092 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 61.1 m -61.39 -39.96 92.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.147 -0.971 . . . . 0.22 110.332 -179.263 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -59.59 -24.28 63.64 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.12 -0.987 . . . . 0.22 110.113 -178.801 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -51.83 -36.53 48.36 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 120.648 -1.283 . . . . 0.16 108.957 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.7 mp0 -86.14 -14.34 44.41 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.116 -0.99 . . . . 2.16 109.43 179.178 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -80.38 -34.24 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.064 -1.458 . . . . 1.78 107.064 178.049 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -124.79 64.25 1.12 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.372 -1.344 . . . . 0.25 107.372 177.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -61.52 -9.7 6.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.542 -0.724 . . . . 0.22 109.27 -179.271 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -91.6 9.83 30.58 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.336 -0.987 . . . . 1.13 108.336 179.216 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.52 HG13 ' HB3' ' A' ' 22' ' ' LEU . 47.8 t -127.39 142.11 44.49 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 N-CA-C 106.683 -1.599 . . . . 0.24 106.683 178.575 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -99.79 119.61 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.053 -1.029 . . . . 0.15 109.425 -178.424 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.524 ' C ' HD12 ' A' ' 55' ' ' LEU . 30.0 m-85 -99.07 124.43 44.07 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.309 -0.87 . . . . 0.12 110.293 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.524 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.7 mp -109.16 141.43 41.38 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.168 -0.958 . . . . 0.22 109.095 178.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -110.02 132.35 54.24 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 106.925 -1.509 . . . . 1.13 106.925 178.101 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.416 HG21 ' CG1' ' A' ' 25' ' ' VAL . 40.9 t -128.38 132.54 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.476 -0.765 . . . . 0.15 110.416 -177.894 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 27.8 t0 -95.81 119.6 34.58 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.458 -0.776 . . . . 1.05 109.044 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.59 -16.57 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.469 -1.394 . . . . 0.16 108.598 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.6 m-20 -92.11 -42.91 9.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.449 -0.782 . . . . 1.08 111.506 -178.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -97.32 -23.4 16.14 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.869 -1.144 . . . . 1.07 108.638 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -114.08 36.36 3.74 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.828 -1.545 . . . . 0.14 106.828 179.191 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.3 OUTLIER -59.67 -20.53 56.85 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.657 -0.702 . . . . 1.47 110.037 -178.736 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.651 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -67.13 -37.43 83.84 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.98 -1.075 . . . . 1.05 109.201 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.651 HG23 ' OD1' ' A' ' 64' ' ' ASP . 19.0 t -72.89 -43.54 59.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.212 -0.93 . . . . 0.35 109.279 179.91 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.77 -40.04 72.87 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.71 -0.619 . . . . 0.26 110.849 -178.464 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.2 p -60.98 -35.41 76.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.514 -1.366 . . . . 0.24 108.864 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.419 ' OE2' ' NZ ' ' A' ' 8' ' ' LYS . 36.9 tt0 -62.22 -39.59 93.29 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.448 -0.782 . . . . 2.06 109.401 178.796 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.74 -2.56 58.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.28 -0.887 . . . . 0.23 110.767 -179.299 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 55.57 49.16 17.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.214 -0.929 . . . . 2.02 109.133 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.1 t -62.74 131.83 28.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 C-N-CA 118.267 -1.373 . . . . 0.16 108.397 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -102.85 -12.42 17.57 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.668 -0.645 . . . . 1.6 109.828 -178.983 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.467 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.22 155.93 18.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.704 -1.247 . . . . 0.14 110.588 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -128.47 153.77 79.28 Favored Pre-proline 0 N--CA 1.5 2.071 0 N-CA-C 107.796 -1.187 . . . . 0.15 107.796 178.642 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -76.51 141.07 68.82 Favored 'Cis proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.797 -1.335 . . . . 0.16 113.331 -2.115 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.467 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.2 m -125.72 135.16 51.77 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 108.246 -1.02 . . . . 0.13 108.246 177.918 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.749 ' CD2' HD21 ' A' ' 97' ' ' LEU . 89.7 m-85 -111.21 132.48 54.29 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.801 -0.815 . . . . 0.2 108.801 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -123.35 141.86 51.55 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.134 -0.979 . . . . 0.29 108.696 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 100' ' ' THR . 90.1 m-85 -109.02 131.45 55.06 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.588 0.709 . . . . 0.14 111.19 -178.504 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -126.57 145.66 50.45 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.395 0.617 . . . . 0.15 109.511 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -147.98 130.39 15.73 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.368 -1.345 . . . . 1.68 107.368 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.3 mttt 57.45 29.45 17.02 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.223 -0.923 . . . . 1.22 108.841 -178.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.66 18.23 79.17 Favored Glycine 0 N--CA 1.49 2.248 0 C-N-CA 120.026 -1.083 . . . . 0.23 110.557 179.811 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -126.82 140.75 52.13 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.185 -1.185 . . . . 2.07 110.467 179.907 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -79.64 129.73 34.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.412 -0.805 . . . . 1.82 108.869 179.198 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.5 m -125.43 3.91 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.588 -0.695 . . . . 0.3 110.187 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.89 156.97 20.05 Favored Glycine 0 N--CA 1.496 2.634 0 C-N-CA 118.108 -1.996 . . . . 0.17 111.984 -179.477 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -165.99 149.62 7.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.977 -0.719 . . . . 1.93 109.719 179.11 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.432 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 17.6 p90 -164.1 160.85 22.01 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.186 -1.005 . . . . 0.14 109.404 177.447 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -126.02 160.75 29.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.647 -0.658 . . . . 0.12 109.901 -179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.493 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 120.91 138.89 5.61 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 108.931 -1.668 . . . . 0.12 108.931 179.885 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.543 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -77.71 65.5 3.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.214 -1.168 . . . . 0.18 110.711 -178.889 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.2 t-20 -118.03 101.66 8.43 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.273 -1.01 . . . . 0.88 108.273 178.109 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' H ' ' HD3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.4 -33.2 72.66 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.332 -0.855 . . . . 1.06 111.3 -179.398 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.8 -29.92 71.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.868 -1.145 . . . . 1.61 109.575 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.436 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 79.2 tttt -62.79 -33.99 76.35 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.637 -0.665 . . . . 1.45 109.392 -179.097 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.749 HD21 ' CD2' ' A' ' 77' ' ' PHE . 39.7 mt -59.86 -39.91 86.83 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.53 -0.915 . . . . 0.19 108.53 179.733 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.05 -42.44 99.72 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.428 -0.909 . . . . 2.1 110.523 -178.451 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.38 77.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.949 -1.094 . . . . 0.19 111.123 -178.412 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.4 HG21 ' CE1' ' A' ' 79' ' ' PHE . 24.5 m -65.98 -39.93 90.76 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.61 -1.306 . . . . 0.2 108.599 -179.822 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.01 -47.0 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.396 -1.335 . . . . 0.16 107.396 177.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.488 ' O ' HG12 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -60.74 -36.77 79.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.504 -0.924 . . . . 0.95 108.504 179.047 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.27 -39.72 82.07 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.759 -0.588 . . . . 2.21 109.878 -179.174 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.682 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.1 mt -98.33 -2.75 38.65 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.429 -0.794 . . . . 0.25 111.661 -178.632 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.499 1.978 0 O-C-N 120.535 -1.353 . . . . 1.08 109.391 -179.119 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt . . . . . 0 N--CA 1.495 1.785 0 N-CA-C 109.688 -0.486 . . . . 1.31 109.688 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.493 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.4 mm -129.88 140.19 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 121.583 -0.698 . . . . 0.15 109.463 -179.776 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 26.8 m -96.38 127.08 42.05 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 106.896 -1.52 . . . . 0.19 106.896 177.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.7 m -76.89 141.14 40.68 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.958 -1.089 . . . . 0.2 111.123 -178.042 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.7 m95 -77.18 -11.87 59.87 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.009 -1.057 . . . . 0.21 109.32 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.428 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.2 m120 . . . . . 0 C--N 1.301 -1.504 0 N-CA-C 108.636 -0.876 . . . . 0.49 108.636 179.583 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 tppt? . . . . . 0 N--CA 1.495 1.818 0 N-CA-C 108.414 -0.958 . . . . 1.67 108.414 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -98.95 123.07 42.98 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.659 -0.867 . . . . 0.31 108.659 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.6 mm -100.81 114.16 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.761 -0.829 . . . . 0.19 108.761 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.496 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.0 mp0 -97.22 -0.12 47.29 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.241 -0.912 . . . . 2.25 109.751 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.22 156.28 38.21 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.812 -1.18 . . . . 0.15 111.271 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -64.67 -30.92 71.95 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.13 -1.063 . . . . 1.65 108.13 178.323 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -58.21 -49.43 77.09 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.612 -0.835 . . . . 0.23 108.863 -179.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -29.48 67.65 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.43 -0.794 . . . . 0.17 109.079 178.994 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.456 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.6 t80 -59.71 -44.15 93.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.202 -0.936 . . . . 0.14 109.136 -179.834 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -66.93 -42.94 84.47 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.778 -0.769 . . . . 1.31 108.932 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -64.13 -36.55 84.42 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.519 -0.738 . . . . 1.77 110.352 179.569 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.03 -42.83 79.99 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.375 -0.828 . . . . 0.15 109.061 -179.36 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.456 HD11 ' CE2' ' A' ' 11' ' ' PHE . 80.3 mt -60.86 -39.99 91.22 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -0.876 . . . . 0.17 108.662 179.612 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -69.7 -36.4 75.91 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.425 -0.797 . . . . 1.07 109.632 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.16 -36.82 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.435 -0.791 . . . . 0.18 110.269 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.03 -27.53 69.47 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.139 -0.975 . . . . 0.17 109.534 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.29 -129.47 28.74 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.861 -1.295 . . . . 0.2 109.861 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -93.09 7.53 43.8 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.284 -1.127 . . . . 1.07 110.473 -179.112 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -75.6 149.92 38.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.018 -1.051 . . . . 1.5 109.453 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.65 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.08 153.92 20.57 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 107.216 -1.402 . . . . 0.47 107.216 179.73 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.65 ' H ' HD23 ' A' ' 22' ' ' LEU . 63.8 t -143.29 117.38 3.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 121.002 -1.061 . . . . 0.17 108.531 179.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.36 139.27 25.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 108.055 -1.091 . . . . 0.14 108.055 179.573 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.5 t -121.68 123.16 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.401 -0.812 . . . . 0.13 108.941 -179.783 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.545 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.9 t70 -102.75 110.01 21.79 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.649 -0.657 . . . . 1.05 110.924 -179.521 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -90.1 103.79 16.43 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.748 -1.575 . . . . 0.73 106.748 176.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.8 m -130.02 146.97 51.72 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.705 -0.85 . . . . 0.3 108.705 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.706 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.48 121.6 28.41 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.571 -1.27 . . . . 0.22 107.571 179.259 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -65.69 -32.36 73.88 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 118.514 -1.274 . . . . 0.3 107.618 179.801 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.706 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.4 p-90 -70.27 -25.75 63.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.513 -0.742 . . . . 0.26 110.809 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.42 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 5.9 t -83.12 116.85 22.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.812 -1.18 . . . . 0.26 108.458 -179.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.453 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.67 -52.0 55.18 Favored Glycine 0 N--CA 1.49 2.262 0 C-N-CA 120.724 -0.75 . . . . 0.23 111.45 -178.425 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -53.23 -33.19 63.87 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 CA-C-N 118.497 1.148 . . . . 0.31 112.183 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.08 -52.76 8.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.208 -0.932 . . . . 0.24 109.865 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -60.13 -36.73 78.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.03 -1.044 . . . . 1.59 109.611 179.645 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 36.7 tpp -59.65 -28.1 66.94 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.457 -0.777 . . . . 2.1 109.914 -179.49 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.57 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.9 mt -80.22 -4.01 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.49 110.781 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.02 -29.94 6.14 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.371 -1.456 . . . . 0.8 114.47 -177.711 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 39.5 Cg_exo -59.22 -40.55 68.04 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 CA-C-N 122.039 1.764 . . . . 0.28 113.506 -177.452 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -68.1 -47.22 68.8 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 118.295 -1.362 . . . . 0.37 108.74 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.64 -50.77 69.91 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.391 -0.818 . . . . 0.16 109.73 179.126 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -66.77 -41.33 87.9 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.602 -0.686 . . . . 0.32 110.441 -179.517 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.2 m -63.03 -37.73 88.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.236 -0.915 . . . . 0.22 110.652 -179.859 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.07 -25.72 67.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.174 -0.953 . . . . 0.22 110.285 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.6 m -51.44 -39.45 57.4 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.981 -1.075 . . . . 0.16 108.577 -179.359 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -84.48 -16.72 41.49 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.469 -0.769 . . . . 2.16 109.366 179.955 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -78.89 -36.62 41.82 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.776 -1.202 . . . . 1.78 108.179 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.96 66.17 1.04 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.008 -1.479 . . . . 0.25 107.008 177.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.5 p -61.78 -9.71 7.19 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.279 -0.637 . . . . 0.22 109.279 -179.105 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -89.93 9.1 29.04 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.271 -1.011 . . . . 1.13 108.271 179.044 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.8 t -127.37 144.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 107.688 -1.227 . . . . 0.24 107.688 178.739 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.3 mm -99.92 122.76 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 120.99 -1.068 . . . . 0.15 109.594 -178.152 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.605 ' C ' HD12 ' A' ' 55' ' ' LEU . 50.5 m-85 -104.21 124.87 49.89 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.175 -0.953 . . . . 0.12 110.203 -179.813 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.605 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -111.31 140.34 45.96 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.071 -1.018 . . . . 0.22 109.903 178.804 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -110.48 132.01 54.55 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.019 -1.474 . . . . 1.13 107.019 177.84 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 64.7 t -125.63 136.08 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.464 -0.772 . . . . 0.15 110.847 -177.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.547 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.1 t0 -97.04 118.85 34.38 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.396 -0.965 . . . . 1.05 108.396 179.332 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.6 m -68.03 -19.21 24.5 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 O-C-N 120.568 -1.333 . . . . 0.16 108.723 179.56 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.434 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 4.7 m-20 -93.68 -42.36 9.21 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.432 -0.793 . . . . 1.08 111.736 -179.232 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.426 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 52.8 m-20 -94.13 -15.77 24.38 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.574 -1.329 . . . . 1.07 108.489 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.42 4.2 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.505 -1.295 . . . . 0.14 107.505 179.228 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -59.95 -20.21 56.26 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.376 -0.602 . . . . 1.47 109.376 -178.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.679 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -63.94 -39.12 93.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.153 -0.967 . . . . 1.05 109.156 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.679 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.8 t -73.39 -43.22 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.196 -0.94 . . . . 0.35 108.992 179.634 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.57 -40.05 80.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.528 -0.733 . . . . 0.26 110.935 -178.658 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.5 p -60.07 -37.6 80.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.797 -1.189 . . . . 0.24 108.556 -179.75 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.93 -36.1 82.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.502 -0.749 . . . . 2.06 109.143 178.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.94 -2.18 58.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.293 -0.879 . . . . 0.23 111.217 -178.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 52.72 49.95 19.19 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.775 -1.203 . . . . 2.02 109.776 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.3 t -64.94 131.99 30.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 C-N-CA 118.826 -1.15 . . . . 0.16 108.534 -179.413 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -104.29 -12.78 16.43 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.694 -0.629 . . . . 1.6 109.73 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.63 155.8 17.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.996 -1.065 . . . . 0.14 110.526 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.0 154.25 81.18 Favored Pre-proline 0 N--CA 1.501 2.112 0 N-CA-C 108.065 -1.087 . . . . 0.15 108.065 178.582 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -76.0 143.92 78.16 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.987 -1.255 . . . . 0.16 112.852 -2.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.6 m -128.68 135.9 49.9 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 108.493 -0.929 . . . . 0.13 108.493 178.828 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.818 ' CD2' HD21 ' A' ' 97' ' ' LEU . 87.5 m-85 -108.25 129.7 55.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.2 109.187 -179.075 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.3 136.17 54.86 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.164 -1.05 . . . . 0.29 108.164 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -104.57 134.83 47.09 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.417 0.627 . . . . 0.14 110.363 -179.025 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.93 148.95 48.1 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.621 0.724 . . . . 0.15 109.3 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -146.54 122.97 11.02 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.049 -1.463 . . . . 1.68 107.049 179.679 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 74.4 mttt 58.05 27.27 14.63 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.904 -1.147 . . . . 1.22 107.904 -178.403 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.454 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 80.49 11.04 84.58 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.515 -1.034 . . . . 0.23 110.515 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.454 HE21 ' C ' ' A' ' 83' ' ' GLY . 6.4 mm-40 -112.63 134.52 54.11 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.413 -1.051 . . . . 2.07 109.919 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -79.31 123.91 27.9 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.996 -1.113 . . . . 1.82 107.996 178.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.4 m -124.79 12.12 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.809 -0.557 . . . . 0.3 110.452 -179.197 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.41 152.44 11.07 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 118.685 -1.721 . . . . 0.17 111.496 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -167.26 148.89 5.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.723 -0.869 . . . . 1.93 109.87 179.254 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.685 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 21.9 p90 -164.02 162.59 23.25 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 119.652 -0.819 . . . . 0.14 109.127 177.209 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -125.38 160.51 29.2 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 121.609 0.719 . . . . 0.12 110.329 -179.014 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.486 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 118.61 140.06 6.27 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.47 -1.452 . . . . 0.12 109.47 179.684 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.29 66.95 3.99 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.372 -1.075 . . . . 0.18 111.042 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.98 96.88 5.66 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 106.919 -1.512 . . . . 0.88 106.919 177.861 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -37.49 77.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.565 -0.709 . . . . 1.06 112.705 -177.783 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -63.08 -28.86 70.37 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.888 -1.133 . . . . 1.61 109.572 -179.768 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.685 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 21.0 ttpp -63.93 -33.76 76.44 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.584 -0.698 . . . . 1.45 109.682 -179.032 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.818 HD21 ' CD2' ' A' ' 77' ' ' PHE . 34.2 mt -57.96 -38.91 76.89 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.985 -1.117 . . . . 0.19 107.985 179.036 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -60.47 -42.13 95.61 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 115.629 -0.714 . . . . 2.1 110.014 -178.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.08 77.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.182 -0.948 . . . . 0.19 110.958 -179.239 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.34 -39.89 89.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.924 -1.11 . . . . 0.2 109.309 -179.158 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.5 mt -60.91 -49.65 83.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 107.758 -1.201 . . . . 0.16 107.758 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.474 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.0 t-20 -60.06 -35.42 75.1 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.806 0.813 . . . . 0.95 109.024 178.934 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -67.57 -40.0 84.88 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.523 -0.735 . . . . 2.21 109.986 -178.407 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.563 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.3 mt -100.16 1.08 41.71 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.224 -0.923 . . . . 0.25 111.605 -178.756 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.468 -1.395 . . . . 1.08 109.87 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp . . . . . 0 N--CA 1.493 1.719 0 N-CA-C 109.609 -0.515 . . . . 1.31 109.609 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.486 HD11 ' HA2' ' A' ' 91' ' ' GLY . 24.2 mm -129.96 140.49 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 O-C-N 121.765 -0.584 . . . . 0.15 110.065 -179.059 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.9 m -93.24 128.1 39.09 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.309 -1.367 . . . . 0.19 107.309 177.431 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -80.28 137.13 36.56 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.043 -1.036 . . . . 0.2 111.211 -178.287 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 22.6 m95 -73.59 -10.31 59.58 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.091 -1.006 . . . . 0.21 109.309 179.001 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.434 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.9 m120 . . . . . 0 C--N 1.299 -1.6 0 O-C-N 121.596 -0.69 . . . . 0.49 109.355 179.666 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.9 tptp . . . . . 0 N--CA 1.5 2.069 0 N-CA-C 108.174 -1.047 . . . . 1.67 108.174 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . 0.467 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 64.4 tt0 -97.77 122.87 41.38 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.717 -0.846 . . . . 0.31 108.717 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -101.3 114.49 40.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 N-CA-C 107.823 -1.177 . . . . 0.19 107.823 179.432 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.467 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 79.9 mm-40 -97.88 0.07 45.95 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.751 -1.218 . . . . 2.25 110.098 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.0 p -154.19 157.75 39.28 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.087 -1.008 . . . . 0.15 110.951 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.14 -33.91 76.49 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.313 -0.995 . . . . 1.65 108.313 178.487 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.1 m -56.37 -47.95 77.85 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.626 -0.83 . . . . 0.23 109.066 -178.776 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.34 -29.58 68.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.199 -0.938 . . . . 0.17 109.28 178.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.566 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.5 t80 -59.66 -46.03 90.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.93 -1.106 . . . . 0.14 109.22 -179.315 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -65.52 -42.93 91.5 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.067 -0.716 . . . . 1.31 109.067 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -64.34 -36.09 82.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.719 -0.613 . . . . 1.77 109.819 179.57 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.92 -43.29 79.54 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.407 -0.808 . . . . 0.15 109.538 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.566 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.9 mt -61.4 -40.0 92.78 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.176 -0.953 . . . . 0.17 108.698 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -69.28 -38.38 78.32 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.658 0.742 . . . . 1.07 109.336 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.29 -35.48 76.07 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.488 0.661 . . . . 0.18 109.909 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.2 -22.19 64.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 0.17 110.462 -178.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -140.99 37.07 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.006 -1.568 . . . . 0.2 109.71 179.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.83 5.16 49.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.379 -1.071 . . . . 1.07 110.688 -179.11 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.0 mttm -74.06 152.29 39.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.878 -1.138 . . . . 1.5 109.676 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.673 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.01 154.76 18.33 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 108.197 -1.038 . . . . 0.47 108.197 -179.37 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.649 ' H ' HD23 ' A' ' 22' ' ' LEU . 58.2 t -142.56 113.41 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.987 -1.071 . . . . 0.17 109.358 -179.693 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.45 142.57 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 108.087 -1.079 . . . . 0.14 108.087 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.0 t -125.51 123.16 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.453 -0.779 . . . . 0.13 109.553 -178.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.517 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 35.5 t70 -98.99 119.54 37.94 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 1.05 109.953 179.588 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -96.63 25.82 4.89 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.237 -0.914 . . . . 0.73 109.577 179.433 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.418 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.2 m -59.99 145.52 45.9 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.146 -0.971 . . . . 0.3 110.23 -178.731 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.713 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.98 124.21 30.81 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.919 -1.141 . . . . 0.22 107.919 179.189 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.1 t -68.24 -29.0 67.71 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 119.29 -0.964 . . . . 0.3 108.585 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.713 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 70.3 p-90 -76.42 -13.74 60.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.023 -1.048 . . . . 0.26 109.881 179.855 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.6 t -90.27 115.64 27.64 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.26 108.596 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.422 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.94 -53.99 40.58 Favored Glycine 0 N--CA 1.489 2.23 0 C-N-CA 120.41 -0.9 . . . . 0.23 111.33 -178.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -50.35 -35.55 44.81 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 CA-C-N 118.768 1.284 . . . . 0.31 112.096 -179.835 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.418 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.21 -47.16 18.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 0.24 110.008 -179.545 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.93 -32.21 70.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.176 -0.953 . . . . 1.59 109.348 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.502 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.83 -29.19 68.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.551 -0.718 . . . . 2.1 110.243 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.559 HD11 ' HB1' ' A' ' 92' ' ' ALA . 21.4 mt -80.99 -4.41 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.655 -0.653 . . . . 0.49 111.069 -179.036 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.01 -31.76 10.16 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 120.138 -1.601 . . . . 0.8 113.211 -177.409 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.76 -36.38 91.57 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 121.573 1.597 . . . . 0.28 112.162 -178.421 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -72.37 -51.81 18.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 118.953 -1.099 . . . . 0.37 108.498 179.588 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.81 -47.23 86.53 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.391 -0.818 . . . . 0.16 109.056 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -68.36 -43.03 78.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.557 -0.715 . . . . 0.32 110.877 179.667 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.8 m -64.03 -38.23 90.3 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.954 -1.091 . . . . 0.22 110.679 -179.306 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.92 -23.92 66.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.396 -0.815 . . . . 0.22 110.735 -178.376 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.2 m -54.26 -38.05 65.37 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.793 -1.192 . . . . 0.16 108.397 -179.426 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.63 -17.87 40.07 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.283 -0.886 . . . . 2.16 109.256 178.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -76.34 -36.82 58.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.749 -1.219 . . . . 1.78 108.004 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -123.53 65.69 1.01 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 106.58 -1.637 . . . . 0.25 106.58 178.108 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -62.41 -9.78 9.42 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.53 -0.915 . . . . 0.22 108.53 -179.396 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -89.37 8.9 28.31 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.787 -1.19 . . . . 1.13 107.787 178.727 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.428 HG13 ' HB3' ' A' ' 22' ' ' LEU . 58.4 t -127.87 145.16 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 N-CA-C 108.161 -1.052 . . . . 0.24 108.161 179.152 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.01 122.47 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.065 -1.022 . . . . 0.15 109.249 -179.12 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.602 ' C ' HD12 ' A' ' 55' ' ' LEU . 33.4 m-85 -103.68 129.31 50.99 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.169 -0.957 . . . . 0.12 109.521 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.602 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -111.94 142.37 44.43 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.126 -0.984 . . . . 0.22 109.985 179.168 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 107.016 -1.476 . . . . 1.13 107.016 177.732 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.7 t -128.86 134.38 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.477 -0.765 . . . . 0.15 110.748 -177.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.573 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.9 t0 -95.19 119.8 34.32 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.485 -0.759 . . . . 1.05 109.232 179.614 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.91 -16.68 21.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.575 -1.328 . . . . 0.16 108.306 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.545 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.1 m-20 -94.1 -44.12 8.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.439 -0.788 . . . . 1.08 111.696 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . 0.456 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 68.7 m-20 -95.81 -14.36 23.33 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.728 -1.232 . . . . 1.07 108.654 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.03 38.23 4.24 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 107.364 -1.347 . . . . 0.14 107.364 179.27 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -59.94 -23.17 63.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.758 -0.589 . . . . 1.47 110.065 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.579 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.7 p30 -65.94 -37.58 86.4 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.042 -1.036 . . . . 1.05 108.9 179.171 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.579 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.8 t -71.34 -44.1 72.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.263 -0.898 . . . . 0.35 109.548 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.09 70.57 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.442 -0.786 . . . . 0.26 111.14 -178.449 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.0 p -60.06 -32.88 71.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.084 -1.01 . . . . 0.24 109.157 -179.243 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -60.66 -38.33 84.53 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.958 -0.756 . . . . 2.06 108.958 179.176 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.432 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -92.02 1.4 57.22 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.438 -0.789 . . . . 0.23 110.809 -179.251 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 54.89 50.51 15.45 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.025 -1.047 . . . . 2.02 109.306 -179.328 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 133.1 30.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 118.324 -1.35 . . . . 0.16 107.959 -179.283 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -105.79 -10.99 16.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 1.6 109.917 -179.121 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.49 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -161.27 156.04 23.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.848 -1.157 . . . . 0.14 111.214 -179.654 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 154.36 81.04 Favored Pre-proline 0 N--CA 1.503 2.204 0 N-CA-C 108.263 -1.014 . . . . 0.15 108.263 179.059 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -76.42 141.63 70.69 Favored 'Cis proline' 0 N--CA 1.495 1.588 0 C-N-CA 123.929 -1.28 . . . . 0.16 112.799 -2.505 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -127.47 132.54 49.99 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.648 0.737 . . . . 0.13 109.39 178.832 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.814 ' CD2' HD21 ' A' ' 97' ' ' LEU . 88.7 m-85 -108.52 131.75 54.51 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.011 -0.737 . . . . 0.2 109.011 179.979 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.432 HE22 ' CB ' ' A' ' 69' ' ' ALA . 73.9 mt-30 -120.72 143.04 48.98 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.395 -0.965 . . . . 0.29 108.395 179.121 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' HG21 ' A' ' 100' ' ' THR . 75.0 m-85 -109.0 133.49 52.91 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 121.708 0.766 . . . . 0.14 110.449 -179.249 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -128.83 143.6 50.95 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 109.383 -0.599 . . . . 0.15 109.383 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -146.37 125.93 13.3 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.71 -1.589 . . . . 1.68 106.71 178.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 58.29 29.42 18.05 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.559 -0.904 . . . . 1.22 108.559 -178.466 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.575 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 77.7 11.73 85.16 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.744 -1.342 . . . . 0.23 109.744 -179.909 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.575 HE21 ' C ' ' A' ' 83' ' ' GLY . 4.5 mm-40 -111.43 132.39 54.5 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.509 -0.994 . . . . 2.07 109.989 -179.053 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -78.41 121.01 23.95 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.048 -1.093 . . . . 1.82 108.048 178.538 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -123.99 11.47 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.777 -0.577 . . . . 0.3 110.627 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -174.2 151.42 12.87 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 118.175 -1.964 . . . . 0.17 112.137 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 3.8 tp10 -163.75 140.22 6.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.923 -0.751 . . . . 1.93 109.218 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.466 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 3.9 p90 -163.87 156.86 18.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.568 -0.707 . . . . 0.14 109.246 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.71 160.25 31.34 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.596 -0.69 . . . . 0.12 110.064 -179.337 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.499 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.85 139.43 5.26 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.347 -1.501 . . . . 0.12 109.347 179.465 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.559 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.54 63.45 2.06 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.353 -1.086 . . . . 0.18 109.68 -179.839 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -118.76 102.25 8.68 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.732 -0.84 . . . . 0.88 108.732 178.557 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.7 -36.25 75.77 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.338 -0.851 . . . . 1.06 111.613 -179.846 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.2 -29.41 69.8 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.844 -1.16 . . . . 1.61 109.472 -179.822 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.489 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 50.5 tttp -60.98 -36.11 78.57 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.591 -0.693 . . . . 1.45 109.205 -179.242 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.814 HD21 ' CD2' ' A' ' 77' ' ' PHE . 45.1 mt -59.05 -39.93 83.56 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-O 122.1 0.952 . . . . 0.19 108.924 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -63.02 -41.58 99.58 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.074 -0.65 . . . . 2.1 111.077 -178.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.03 -43.25 79.19 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.059 -1.026 . . . . 0.19 111.526 -178.293 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . 0.417 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.7 m -66.75 -39.94 88.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.858 -1.151 . . . . 0.2 109.892 -178.332 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.93 -48.97 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.237 -1.023 . . . . 0.16 108.237 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.454 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.7 t-20 -60.16 -35.63 75.74 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.998 0.904 . . . . 0.95 108.675 178.616 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.54 -39.79 85.02 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.994 -0.548 . . . . 2.21 109.956 -177.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.673 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.5 mt -99.79 -1.64 37.13 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.258 -0.901 . . . . 0.25 111.189 -179.173 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.454 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.401 -1.437 . . . . 1.08 109.12 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.5 mmtm . . . . . 0 N--CA 1.495 1.818 0 CA-C-O 120.817 0.342 . . . . 1.31 110.373 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.499 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.5 mm -132.78 142.77 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.523 -0.735 . . . . 0.15 109.149 -179.814 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -103.88 125.86 50.6 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 106.803 -1.554 . . . . 0.19 106.803 177.431 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -79.33 143.85 34.77 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.849 -1.157 . . . . 0.2 111.227 -178.1 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.49 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.3 m95 -75.91 -10.56 59.52 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.229 -0.919 . . . . 0.21 108.718 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.51 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.5 m120 . . . . . 0 N--CA 1.489 1.481 0 N-CA-C 108.589 -0.893 . . . . 0.49 108.589 -179.914 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.4 tptp . . . . . 0 N--CA 1.498 1.942 0 N-CA-C 109.065 -0.717 . . . . 1.67 109.065 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -97.03 123.2 40.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.512 -0.742 . . . . 0.31 109.176 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.34 115.53 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.204 -0.935 . . . . 0.19 108.674 178.712 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -98.15 -0.42 44.33 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 2.25 109.344 179.518 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.57 155.6 35.07 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.672 -1.267 . . . . 0.15 111.944 -179.634 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.23 -33.16 74.06 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.138 -1.06 . . . . 1.65 108.138 178.389 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 80.3 m -58.12 -47.83 82.07 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.406 -0.809 . . . . 0.23 109.329 -179.473 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.74 -30.71 68.38 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.154 -0.966 . . . . 0.17 108.623 178.843 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.492 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.1 t80 -59.57 -43.77 93.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.146 -0.971 . . . . 0.14 108.849 -179.372 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -64.24 -43.31 95.32 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.123 -0.695 . . . . 1.31 109.123 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . 0.557 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -64.4 -39.34 93.66 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.505 -0.747 . . . . 1.77 110.353 179.957 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.85 -41.22 91.97 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.426 -0.796 . . . . 0.15 108.95 -179.301 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.492 HD11 ' CE2' ' A' ' 11' ' ' PHE . 51.6 mt -62.15 -39.99 94.46 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.911 -1.118 . . . . 0.17 108.809 179.414 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.86 -34.8 74.09 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.424 -0.797 . . . . 1.07 109.95 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.45 -36.77 76.93 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.326 -0.859 . . . . 0.18 110.212 -179.606 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.54 80.59 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.229 -0.919 . . . . 0.17 109.373 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.32 -124.58 22.59 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.656 -1.377 . . . . 0.2 109.656 -179.415 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -89.98 2.07 55.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.11 -1.229 . . . . 1.07 110.592 -178.797 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -74.61 150.22 39.74 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.829 -1.169 . . . . 1.5 109.697 -179.933 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.685 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -61.34 156.24 19.41 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.075 -1.454 . . . . 0.47 107.075 179.741 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.599 ' H ' HD23 ' A' ' 22' ' ' LEU . 78.7 t -143.46 112.69 2.03 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 120.991 -1.068 . . . . 0.17 108.94 -179.532 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -103.0 138.85 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 108.498 -0.927 . . . . 0.14 108.498 179.776 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.1 t -122.08 119.66 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.488 -0.757 . . . . 0.13 109.16 -179.441 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.571 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.5 t70 -98.99 109.09 21.9 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.525 -0.735 . . . . 1.05 110.344 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -89.95 102.81 15.52 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 106.754 -1.573 . . . . 0.73 106.754 177.548 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.0 m -129.01 146.56 50.95 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.794 -0.817 . . . . 0.3 108.794 -179.743 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.552 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.73 122.67 30.15 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.777 -1.194 . . . . 0.22 107.777 179.104 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -65.72 -34.09 77.38 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 118.92 -1.112 . . . . 0.3 108.724 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.552 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 46.2 p-90 -70.73 -23.56 62.46 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.366 -0.833 . . . . 0.26 110.634 179.797 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -84.2 112.97 20.75 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.621 -1.251 . . . . 0.26 107.621 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.494 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.61 -49.16 81.53 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 120.415 -0.898 . . . . 0.23 111.086 -178.298 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.6 Cg_exo -53.46 -35.38 75.77 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 CA-C-N 118.616 1.208 . . . . 0.31 112.704 179.913 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.97 -55.77 5.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.228 -0.92 . . . . 0.24 109.928 -179.682 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -59.82 -37.43 79.17 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.144 -0.973 . . . . 1.59 109.421 -179.837 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.401 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 37.6 ttm -59.69 -28.95 67.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.995 . . . . 2.1 109.994 -179.618 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.586 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -80.05 -4.5 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.725 -0.609 . . . . 0.49 110.926 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -65.39 -26.11 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 120.382 -1.449 . . . . 0.8 114.604 -177.548 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.6 Cg_exo -57.56 -37.99 95.25 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 CA-C-N 122.536 1.941 . . . . 0.28 113.148 -176.648 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -69.88 -43.31 72.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.049 -1.46 . . . . 0.37 108.478 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -63.65 -50.57 68.76 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.001 0.905 . . . . 0.16 109.788 179.208 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -68.01 -44.03 77.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 121.237 0.541 . . . . 0.32 109.691 179.701 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.1 m -60.71 -37.15 80.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.983 -1.073 . . . . 0.22 110.498 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -63.48 -22.3 66.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.705 -1.247 . . . . 0.22 110.833 -178.527 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -53.71 -37.4 63.26 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.967 -1.083 . . . . 0.16 108.279 -179.252 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 54.7 mp0 -85.65 -17.73 35.24 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.066 -1.021 . . . . 2.16 109.47 179.708 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.28 -35.71 54.87 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.754 -1.202 . . . . 1.78 107.754 179.228 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -124.94 66.57 1.11 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 106.906 -1.516 . . . . 0.25 106.906 178.025 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -64.2 -7.96 10.88 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.829 -0.804 . . . . 0.22 108.829 -179.129 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -91.09 10.16 27.97 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 108.458 -0.941 . . . . 1.13 108.458 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.401 HG13 ' HB3' ' A' ' 22' ' ' LEU . 44.7 t -128.03 149.92 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 N-CA-C 107.996 -1.113 . . . . 0.24 107.996 179.392 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.0 mm -100.72 122.19 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.791 -1.193 . . . . 0.15 109.044 -178.839 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.623 ' C ' HD12 ' A' ' 55' ' ' LEU . 63.6 m-85 -106.95 128.88 54.72 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.071 -1.018 . . . . 0.12 109.33 179.753 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.623 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -114.95 142.25 46.87 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.924 -1.11 . . . . 0.22 109.5 179.183 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -111.77 130.13 55.9 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 106.753 -1.573 . . . . 1.13 106.753 177.703 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -126.39 137.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.267 -0.896 . . . . 0.15 111.741 -177.571 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.2 t0 -99.1 119.56 38.04 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.702 -0.851 . . . . 1.05 108.702 179.14 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -70.33 -16.95 20.4 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 O-C-N 120.946 -1.096 . . . . 0.16 108.918 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 4.3 m-20 -95.2 -39.6 10.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 1.08 111.547 -179.376 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -96.24 -17.96 20.38 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 120.832 -1.167 . . . . 1.07 108.216 179.453 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.92 41.2 3.57 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.477 -1.305 . . . . 0.14 107.477 179.031 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.43 -25.67 66.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.831 -0.543 . . . . 1.47 109.697 -178.747 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.614 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -62.97 -38.68 92.08 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.912 -1.118 . . . . 1.05 109.162 179.241 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.614 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -70.51 -44.27 77.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 121.193 -0.942 . . . . 0.35 109.868 -179.843 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.01 -37.31 69.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.364 -0.835 . . . . 0.26 111.255 -178.879 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.0 p -60.27 -33.96 73.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.793 -1.192 . . . . 0.24 109.381 -178.865 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.67 -36.57 84.28 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.576 -0.702 . . . . 2.06 109.801 179.615 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.88 -1.95 58.35 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.426 -0.797 . . . . 0.23 111.302 -178.781 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 56.94 48.8 15.14 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.033 -1.042 . . . . 2.02 109.578 -179.288 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.0 t -64.39 129.78 28.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 120.809 -1.182 . . . . 0.16 108.056 -179.828 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -103.04 -11.77 17.9 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.718 -0.613 . . . . 1.6 109.982 -179.387 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.508 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.68 154.24 17.97 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.801 -1.187 . . . . 0.14 110.377 179.767 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.408 HG23 ' NE1' ' B' ' 67' ' ' TRP . 33.0 p -130.12 155.55 80.58 Favored Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.146 -0.971 . . . . 0.15 108.767 179.039 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -73.56 144.67 81.74 Favored 'Cis proline' 0 N--CA 1.493 1.495 0 C-N-CA 123.934 -1.277 . . . . 0.16 112.999 -2.586 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.4 m -130.1 134.7 47.53 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.033 -1.099 . . . . 0.13 108.033 178.69 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.571 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -109.88 131.25 55.23 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.426 -0.796 . . . . 0.2 109.129 -179.14 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -124.3 140.43 52.97 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.289 -1.004 . . . . 0.29 108.289 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -108.29 135.85 48.91 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 121.436 0.636 . . . . 0.14 110.232 -179.32 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.02 146.53 50.32 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.669 -0.863 . . . . 0.15 108.669 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -143.4 121.64 12.25 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.759 -1.2 . . . . 1.68 107.759 -179.843 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 60.03 27.35 16.76 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.596 -0.69 . . . . 1.22 109.857 -179.427 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.24 Favored Glycine 0 N--CA 1.495 2.623 0 O-C-N 120.899 -1.126 . . . . 0.23 110.994 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -127.05 142.2 51.59 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.049 -1.265 . . . . 2.07 110.172 -179.781 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . 0.457 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 33.1 ttpt -79.6 126.75 31.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.243 -0.911 . . . . 1.82 108.977 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.5 m -119.98 11.55 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.647 -0.658 . . . . 0.3 110.683 -179.21 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 165.03 157.31 9.61 Favored Glycine 0 N--CA 1.492 2.403 0 C-N-CA 118.501 -1.809 . . . . 0.17 111.492 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 12.3 pt-20 -165.97 158.11 14.45 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.775 -0.838 . . . . 1.93 109.794 179.231 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -164.09 163.26 23.21 Favored 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 119.27 -0.972 . . . . 0.14 109.976 176.844 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.26 160.73 29.51 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 121.633 0.73 . . . . 0.12 110.175 -179.357 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.527 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 116.58 141.77 7.2 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 108.776 -1.729 . . . . 0.12 108.776 -179.873 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.1 68.5 4.15 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.315 -1.109 . . . . 0.18 111.489 -178.84 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.447 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -117.84 100.4 7.56 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 108.289 -1.004 . . . . 0.88 108.289 177.871 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.469 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.03 -33.27 73.35 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.173 -0.954 . . . . 1.06 111.619 -179.263 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.86 -29.06 69.45 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.621 -1.3 . . . . 1.61 110.063 -179.225 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.447 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 43.3 tttp -60.93 -34.31 74.51 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.509 -0.923 . . . . 1.45 108.509 -179.086 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.417 HD21 ' CD1' ' A' ' 77' ' ' PHE . 43.3 mt -60.13 -40.05 88.43 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.714 0.768 . . . . 0.19 109.008 179.777 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.32 -41.89 98.92 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.988 -0.685 . . . . 2.1 110.836 -177.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.94 -43.96 70.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.19 111.454 -178.514 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.6 m -65.3 -39.99 93.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.088 -1.007 . . . . 0.2 109.883 -178.76 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . 0.402 ' O ' ' N ' ' A' ' 105' ' ' VAL . 63.9 mt -61.52 -48.54 88.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 108.002 -1.11 . . . . 0.16 108.002 179.235 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.9 t-20 -60.2 -36.36 77.48 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.409 -0.96 . . . . 0.95 108.409 178.727 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.59 85.75 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.637 -0.505 . . . . 2.21 109.637 -178.984 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.685 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.9 mt -99.86 -3.15 33.15 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.126 -0.984 . . . . 0.25 111.626 -179.042 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.46 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.397 -1.439 . . . . 1.08 109.119 -179.518 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm . . . . . 0 N--CA 1.488 1.428 0 N-CA-C 110.228 -0.286 . . . . 1.31 110.228 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.527 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.3 mm -129.92 146.99 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 109.543 -0.539 . . . . 0.15 109.543 -179.968 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 60.9 m -104.59 126.27 51.52 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 107.176 -1.416 . . . . 0.19 107.176 177.848 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.0 m -77.46 138.18 39.09 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.672 -1.267 . . . . 0.2 111.016 -178.567 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.408 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.8 m95 -75.05 -9.63 58.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.012 -1.055 . . . . 0.21 109.556 179.056 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 C--N 1.3 -1.55 0 O-C-N 121.335 -0.853 . . . . 0.49 109.122 -179.891 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 tptm . . . . . 0 N--CA 1.496 1.844 0 N-CA-C 108.238 -1.023 . . . . 1.67 108.238 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -98.13 124.52 42.71 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.21 -0.931 . . . . 0.31 108.96 179.566 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.2 mm -100.92 113.83 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.389 -0.819 . . . . 0.19 108.824 179.165 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -98.47 -0.38 43.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.318 -0.864 . . . . 2.25 109.395 179.077 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -154.33 155.7 35.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.971 -1.081 . . . . 0.15 111.324 179.587 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -62.66 -30.92 71.74 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.247 -1.02 . . . . 1.65 108.247 178.478 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.1 m -59.02 -48.7 80.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.35 -0.94 . . . . 0.23 108.701 -179.573 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.14 -28.8 67.62 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.85 -0.74 . . . . 0.17 109.067 179.079 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.478 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.0 t80 -59.89 -43.84 94.55 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.097 -1.002 . . . . 0.14 108.568 -179.683 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.89 -42.17 85.97 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.312 -0.625 . . . . 1.31 109.312 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.8 -37.14 86.6 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.43 0.633 . . . . 1.77 110.046 -179.814 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.06 80.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.289 -0.882 . . . . 0.15 108.999 -179.696 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.478 HD11 ' CE2' ' A' ' 11' ' ' PHE . 71.2 mt -61.02 -39.84 91.3 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.108 -0.995 . . . . 0.17 108.917 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.65 -35.27 75.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.532 -0.73 . . . . 1.07 110.2 -179.629 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.05 -37.5 75.57 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.341 -0.849 . . . . 0.18 110.801 -178.952 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.11 72.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.098 -1.002 . . . . 0.17 109.757 -179.503 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.22 20.23 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 110.24 -1.144 . . . . 0.2 110.24 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . 0.402 ' OD1' ' NZ ' ' A' ' 82' ' ' LYS . 70.7 m-20 -90.7 1.76 56.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.157 -1.201 . . . . 1.07 110.554 -178.48 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -75.73 150.12 37.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.014 -1.054 . . . . 1.5 110.251 -178.807 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.693 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.93 154.26 22.81 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 107.605 -1.257 . . . . 0.47 107.605 -179.665 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.693 ' H ' HD23 ' A' ' 22' ' ' LEU . 90.4 t -144.41 116.13 2.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.057 -1.027 . . . . 0.17 108.646 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.2 t -105.08 142.6 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 107.959 -1.126 . . . . 0.14 107.959 179.497 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . 0.4 ' CG1' HG21 ' A' ' 57' ' ' VAL . 21.7 t -125.31 123.17 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 O-C-N 121.179 -0.951 . . . . 0.13 109.514 -179.233 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.558 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 32.8 t70 -100.64 120.07 39.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.343 -0.848 . . . . 1.05 110.427 179.303 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -97.29 25.58 5.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.335 -0.853 . . . . 0.73 110.336 179.315 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.3 m -59.47 146.62 39.63 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.923 -1.111 . . . . 0.3 110.061 -178.662 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.588 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.15 126.84 33.04 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.699 -1.223 . . . . 0.22 107.699 179.34 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 t -68.06 -34.92 77.34 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.148 -1.021 . . . . 0.3 108.365 -179.841 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.588 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.8 p-90 -69.86 -22.34 63.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.43 -0.794 . . . . 0.26 110.539 179.576 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.7 t -85.11 106.49 16.61 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.526 -1.287 . . . . 0.26 107.526 179.695 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.518 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.83 -46.85 92.92 Favored Glycine 0 N--CA 1.487 2.08 0 C-N-CA 120.363 -0.922 . . . . 0.23 111.084 -178.469 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -52.35 -36.21 67.82 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.942 1.371 . . . . 0.31 111.663 179.682 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.16 -49.4 13.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.493 -0.754 . . . . 0.24 109.954 179.98 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -59.9 -31.55 69.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.232 -0.918 . . . . 1.59 109.276 179.894 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.519 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -59.91 -29.79 68.6 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.252 -0.905 . . . . 2.1 109.587 -179.465 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 mt -81.55 -8.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.532 -0.73 . . . . 0.49 111.34 -179.186 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.517 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.5 ptmt -61.67 -28.38 3.95 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 120.27 -1.519 . . . . 0.8 113.621 -177.253 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.9 Cg_exo -57.63 -37.84 95.51 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 122.696 1.999 . . . . 0.28 112.178 -176.828 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -68.57 -47.72 66.07 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.601 -1.24 . . . . 0.37 108.113 179.306 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -60.34 -52.12 66.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.669 -0.644 . . . . 0.16 109.674 178.752 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -68.2 -40.28 82.2 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.478 -0.764 . . . . 0.32 110.836 -179.724 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.42 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.9 m -62.81 -39.08 93.18 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.952 -1.093 . . . . 0.22 110.666 -179.802 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.5 mt -63.18 -23.9 67.64 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.163 -0.961 . . . . 0.22 111.044 -178.383 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -53.33 -36.78 61.66 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 120.712 -1.243 . . . . 0.16 108.699 -179.18 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.2 mp0 -87.24 -14.02 42.2 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.267 -0.896 . . . . 2.16 109.179 179.395 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.29 -38.07 36.23 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.152 -1.425 . . . . 1.78 107.152 178.908 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.74 68.28 0.91 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 106.856 -1.535 . . . . 0.25 106.856 178.002 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.66 -9.07 12.0 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.748 -0.834 . . . . 0.22 108.748 -179.331 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.04 7.18 36.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.875 -1.157 . . . . 1.13 107.875 178.861 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.9 t -127.45 144.82 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 107.791 -1.189 . . . . 0.24 107.791 178.777 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.6 mm -100.02 121.05 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.027 -1.046 . . . . 0.15 109.419 -178.804 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.568 ' C ' HD12 ' A' ' 55' ' ' LEU . 35.6 m-85 -102.06 125.54 48.77 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.16 -0.963 . . . . 0.12 109.2 179.266 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.592 HD12 ' N ' ' A' ' 55' ' ' LEU . 6.7 mp -108.63 140.87 41.39 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.04 -1.038 . . . . 0.22 109.361 179.613 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -108.92 132.07 54.42 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.273 -1.751 . . . . 1.13 106.273 177.978 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . 0.4 HG21 ' CG1' ' A' ' 25' ' ' VAL . 42.5 t -130.72 133.61 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.295 -0.878 . . . . 0.15 110.76 -177.659 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.614 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.0 t0 -96.02 119.0 33.73 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.865 -0.791 . . . . 1.05 108.865 179.681 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.25 -16.82 21.5 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 O-C-N 120.524 -1.36 . . . . 0.16 108.784 179.319 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.54 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.3 m-20 -94.78 -40.19 9.89 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.433 -0.792 . . . . 1.08 111.623 -178.467 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -98.09 -15.46 19.97 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.826 -1.171 . . . . 1.07 107.938 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.614 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.89 38.47 4.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.621 -1.251 . . . . 0.14 107.621 179.389 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -59.88 -27.74 66.96 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.731 -0.605 . . . . 1.47 109.859 -178.608 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.548 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -64.03 -36.0 82.55 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.686 -1.259 . . . . 1.05 109.155 179.591 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.548 HG23 ' OD1' ' A' ' 64' ' ' ASP . 5.7 t -71.76 -44.06 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.309 -0.869 . . . . 0.35 109.622 179.914 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.75 69.04 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.384 -0.822 . . . . 0.26 110.287 -179.187 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -60.11 -30.47 69.28 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.197 -0.94 . . . . 0.24 108.97 -179.442 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -60.54 -39.92 89.64 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.909 -0.775 . . . . 2.06 108.909 178.881 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.439 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -91.46 0.93 57.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.28 -0.887 . . . . 0.23 110.717 -179.309 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 55.76 49.97 15.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.992 -1.068 . . . . 2.02 109.134 -178.945 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -62.8 130.51 27.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 C-N-CA 118.323 -1.351 . . . . 0.16 108.363 -178.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -102.22 -10.63 19.41 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.656 -0.652 . . . . 1.6 109.889 -178.933 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.47 156.09 18.24 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.698 -1.251 . . . . 0.14 111.129 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -126.79 155.66 74.93 Favored Pre-proline 0 N--CA 1.497 1.903 0 N-CA-C 107.699 -1.222 . . . . 0.15 107.699 178.309 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -76.84 140.1 63.24 Favored 'Cis proline' 0 N--CA 1.492 1.411 0 C-N-CA 123.63 -1.404 . . . . 0.16 112.271 -2.275 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.0 m -125.14 132.52 53.07 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.816 -0.809 . . . . 0.13 108.816 177.799 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.558 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.4 m-85 -110.51 131.4 55.08 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.752 -0.832 . . . . 0.2 108.752 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.439 HE22 ' CB ' ' A' ' 69' ' ' ALA . 74.8 mt-30 -122.89 139.13 54.37 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.322 -0.861 . . . . 0.29 109.11 179.465 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -105.12 136.21 45.03 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.332 0.586 . . . . 0.14 110.401 -179.392 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -129.07 146.99 50.89 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 109.258 -0.645 . . . . 0.15 109.258 179.362 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -145.93 122.67 11.21 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.615 -1.254 . . . . 1.68 107.615 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . 0.402 ' NZ ' ' OD1' ' A' ' 20' ' ' ASP . 55.3 mttm 56.71 34.49 24.68 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.998 -1.064 . . . . 1.22 109.043 -177.945 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.22 20.44 79.65 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 109.894 -1.282 . . . . 0.23 109.894 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -123.96 132.13 53.67 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.369 -1.077 . . . . 2.07 110.794 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -79.02 124.01 27.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.422 -0.799 . . . . 1.82 109.021 178.923 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.82 9.27 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.656 -0.652 . . . . 0.3 110.977 -179.634 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.85 155.43 15.53 Favored Glycine 0 N--CA 1.495 2.586 0 C-N-CA 118.244 -1.931 . . . . 0.17 111.569 -179.616 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -166.78 148.73 6.28 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.818 -0.813 . . . . 1.93 109.549 179.512 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 10.4 p90 -163.91 159.5 21.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.14 109.377 178.348 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.3 p -125.79 162.31 25.4 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.044 -0.724 . . . . 0.12 109.044 -179.525 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.448 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.11 139.78 5.67 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.586 -1.406 . . . . 0.12 109.586 179.831 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 63.6 1.93 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.453 -1.028 . . . . 0.18 110.338 -179.64 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . 0.428 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.2 t-20 -119.12 99.93 7.02 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.531 -0.914 . . . . 0.88 108.531 178.541 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.438 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.1 OUTLIER -69.8 -31.43 69.33 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 1.06 111.597 -179.201 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.14 -28.87 69.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.779 -1.201 . . . . 1.61 109.763 -179.589 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . 0.428 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 77.1 tttt -61.19 -34.97 75.92 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.655 -0.868 . . . . 1.45 108.655 -179.432 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.1 mt -59.97 -39.85 87.08 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 122.124 0.964 . . . . 0.19 108.478 179.01 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -61.18 -41.46 96.83 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.853 -0.612 . . . . 2.1 111.293 -178.115 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.36 73.0 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.851 -1.156 . . . . 0.19 112.168 -178.082 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.9 m -66.56 -39.7 88.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.73 -1.232 . . . . 0.2 110.142 -178.485 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.4 mt -60.18 -50.59 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.106 -0.996 . . . . 0.16 108.699 179.897 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.495 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.4 t30 -61.5 -33.62 74.1 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.694 -0.854 . . . . 0.95 108.694 179.189 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -68.1 -41.38 81.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 2.21 110.69 -178.956 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.624 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.4 mt -97.64 -2.14 42.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -0.925 . . . . 0.25 110.951 -178.683 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.2 p . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.624 -1.298 . . . . 1.08 109.222 -179.526 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 60.3 mmtt . . . . . 0 N--CA 1.491 1.623 0 N-CA-C 109.256 -0.646 . . . . 1.31 109.256 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.448 HD11 ' HA2' ' A' ' 91' ' ' GLY . 38.5 mm -128.83 140.37 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 N-CA-C 109.411 -0.589 . . . . 0.15 109.411 179.845 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.8 m -100.97 126.79 47.65 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.492 -1.299 . . . . 0.19 107.492 177.549 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.8 m -79.01 140.82 37.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.781 -1.2 . . . . 0.2 110.909 -178.512 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.466 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.1 m95 -74.27 -10.01 59.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.898 . . . . 0.21 109.578 179.499 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 N--CA 1.488 1.47 0 O-C-N 121.137 -0.977 . . . . 0.49 108.457 -179.869 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.2 tttp . . . . . 0 N--CA 1.496 1.85 0 N-CA-C 108.81 -0.811 . . . . 1.67 108.81 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -97.86 126.1 43.07 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.237 -1.023 . . . . 0.31 108.237 179.464 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.4 mm -100.04 112.06 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.262 -1.014 . . . . 0.19 108.262 179.795 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -96.48 -0.38 49.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.13 -0.981 . . . . 2.25 109.727 -179.655 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -153.19 155.43 36.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.967 -1.083 . . . . 0.15 110.841 179.765 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -64.25 -33.34 75.6 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 107.981 -1.118 . . . . 1.65 107.981 178.545 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 37.1 m -57.08 -48.23 79.1 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.49 -0.93 . . . . 0.23 108.49 -179.361 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.22 -29.25 68.04 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.83 . . . . 0.17 109.125 178.942 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.472 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.4 t80 -60.04 -44.64 94.52 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -0.949 . . . . 0.14 108.731 -179.942 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -65.38 -43.57 90.29 Favored 'General case' 0 C--N 1.297 -1.704 0 C-N-CA 119.64 -0.824 . . . . 1.31 109.031 179.631 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.8 -36.34 84.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.4 -0.813 . . . . 1.77 110.282 179.383 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -43.24 79.34 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.454 -0.779 . . . . 0.15 108.975 -179.503 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.472 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.2 mt -60.37 -40.22 90.07 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.027 -1.101 . . . . 0.17 108.027 179.709 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.32 -34.64 74.95 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.281 -0.887 . . . . 1.07 109.861 179.841 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.2 -36.24 79.26 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.45 -0.781 . . . . 0.18 110.472 -179.109 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.12 -30.75 71.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.215 -0.928 . . . . 0.17 109.208 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.43 -126.44 25.1 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 109.358 -1.497 . . . . 0.2 109.358 -179.618 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -91.69 3.54 54.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.32 -1.106 . . . . 1.07 110.804 -179.273 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -74.86 149.45 39.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.663 -1.273 . . . . 1.5 108.995 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.687 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.59 160.14 5.82 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 106.992 -1.484 . . . . 0.47 106.992 179.369 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.687 ' H ' HD23 ' A' ' 22' ' ' LEU . 95.7 t -147.5 119.63 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 O-C-N 120.962 -1.086 . . . . 0.17 108.321 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.416 HG22 ' CE2' ' A' ' 79' ' ' PHE . 45.4 t -106.91 142.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 107.721 -1.214 . . . . 0.14 107.721 179.267 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.9 t -124.64 120.2 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.349 -0.844 . . . . 0.13 108.913 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . 0.567 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.4 t70 -98.61 108.71 21.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.331 -0.856 . . . . 1.05 111.628 -179.319 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -90.1 101.01 13.73 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.4 -1.704 . . . . 0.73 106.4 176.602 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.3 m -129.94 145.59 51.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.955 -1.128 . . . . 0.3 107.955 -179.66 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.773 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.15 122.98 29.59 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.567 -1.272 . . . . 0.22 107.567 179.474 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -63.3 -29.3 70.65 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.887 -1.153 . . . . 0.3 107.887 -179.859 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.773 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 69.6 p-90 -78.97 -10.95 59.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.475 -0.766 . . . . 0.26 111.144 -179.887 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 34.6 t -87.63 116.29 25.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.709 -1.244 . . . . 0.26 108.53 -179.674 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.467 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.47 -52.81 50.29 Favored Glycine 0 N--CA 1.487 2.068 0 C-N-CA 120.84 -0.695 . . . . 0.23 112.002 -178.472 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.6 Cg_endo -60.33 -28.87 87.66 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 CA-C-N 119.742 1.771 . . . . 0.31 113.148 -179.685 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.89 -47.46 21.11 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.721 -1.237 . . . . 0.24 110.018 -179.735 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -59.98 -32.27 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.293 -0.879 . . . . 1.59 109.411 179.601 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 18.3 tmm? -60.11 -29.64 68.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.591 -0.693 . . . . 2.1 109.639 -179.934 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 38' ' ' ILE . 16.9 mt -81.59 -5.79 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.791 -0.568 . . . . 0.49 111.282 -179.107 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.559 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.62 -31.04 8.52 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 119.896 -1.753 . . . . 0.8 113.427 -177.927 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.1 Cg_exo -60.04 -40.54 60.32 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 CA-C-N 121.297 1.499 . . . . 0.28 112.821 -178.204 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -70.17 -47.91 59.56 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.746 -1.222 . . . . 0.37 108.673 179.798 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.58 -50.66 72.64 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.302 -0.874 . . . . 0.16 109.004 179.481 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -67.85 -40.24 83.7 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.699 -0.625 . . . . 0.32 111.276 179.187 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 75.3 m -63.58 -39.31 94.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.647 -1.283 . . . . 0.22 110.635 -179.342 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.3 mt -60.13 -27.15 66.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.396 -0.815 . . . . 0.22 110.909 -178.571 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.5 m -50.09 -37.5 34.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.975 -1.078 . . . . 0.16 108.986 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.2 mp0 -87.59 -16.75 33.66 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.205 -0.935 . . . . 2.16 108.942 179.698 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -77.73 -35.99 51.32 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.316 -1.365 . . . . 1.78 107.316 179.462 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -124.28 69.21 1.07 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.261 -1.385 . . . . 0.25 107.261 177.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.0 p -65.66 -8.97 23.39 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.729 -0.841 . . . . 0.22 108.729 -179.511 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -91.13 10.15 28.12 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.72 146.42 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.706 -1.22 . . . . 0.24 107.706 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.93 121.43 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.818 -1.176 . . . . 0.15 109.78 -178.949 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.534 ' C ' HD12 ' A' ' 55' ' ' LEU . 45.6 m-85 -102.78 124.2 47.87 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.255 -0.903 . . . . 0.12 109.999 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.2 mp -110.18 142.7 41.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.266 -0.896 . . . . 0.22 109.017 178.872 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -113.02 130.32 56.18 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 106.738 -1.578 . . . . 1.13 106.738 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.77 134.18 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.051 -1.031 . . . . 0.15 111.171 -177.777 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.701 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 53.5 t0 -98.97 119.44 37.75 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.499 -0.926 . . . . 1.05 108.499 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.6 m -69.09 -17.7 22.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 O-C-N 120.734 -1.229 . . . . 0.16 108.889 179.349 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.0 m-20 -92.64 -39.95 11.02 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.44 -0.788 . . . . 1.08 110.939 -179.079 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -98.5 -12.25 21.47 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.864 -1.148 . . . . 1.07 107.935 178.976 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -127.58 39.33 3.9 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.285 -1.376 . . . . 0.14 107.285 179.3 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -59.78 -27.74 66.81 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 115.868 -0.606 . . . . 1.47 109.385 -178.757 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.69 -38.14 88.41 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.187 -0.946 . . . . 1.05 109.329 179.353 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.527 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 8.9 t -69.72 -44.15 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.121 -0.987 . . . . 0.35 109.364 -179.917 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.36 -39.14 71.46 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.743 -0.598 . . . . 0.26 110.592 -179.036 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -61.17 -36.35 79.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.038 -1.039 . . . . 0.24 109.844 -179.01 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -61.98 -37.19 83.88 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.09 -1.006 . . . . 2.06 109.392 179.431 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.71 -0.88 57.73 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.342 -0.849 . . . . 0.23 111.364 -178.672 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 56.3 52.2 10.49 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.203 -0.936 . . . . 2.02 109.438 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.7 t -66.48 130.94 32.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 118.371 -1.332 . . . . 0.16 108.575 -179.169 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -104.06 -11.01 17.61 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.681 -0.637 . . . . 1.6 109.522 -179.422 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.416 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.54 154.28 16.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.878 -1.139 . . . . 0.14 110.938 179.906 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.8 p -129.63 156.08 79.31 Favored Pre-proline 0 N--CA 1.499 1.988 0 N-CA-C 106.828 -1.545 . . . . 0.15 106.828 178.447 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -76.16 140.94 68.69 Favored 'Cis proline' 0 N--CA 1.49 1.292 0 C-N-CA 123.818 -1.326 . . . . 0.16 111.788 -3.04 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.9 m -128.46 135.1 49.0 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.68 -0.859 . . . . 0.13 108.68 178.784 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.567 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.3 m-85 -108.83 128.83 55.24 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.873 -0.788 . . . . 0.2 108.873 -179.43 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -121.15 140.02 52.56 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.62 -1.252 . . . . 0.29 107.62 178.773 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.416 ' CE2' HG22 ' A' ' 24' ' ' VAL . 69.6 m-85 -107.72 135.08 49.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.257 0.551 . . . . 0.14 110.241 -178.942 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -126.88 147.23 50.07 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.165 -0.68 . . . . 0.15 109.165 178.985 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -146.16 125.08 12.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 106.986 -1.487 . . . . 1.68 106.986 179.378 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 57.97 27.1 14.26 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.099 -1.074 . . . . 1.22 108.099 -178.296 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . 0.451 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 80.53 11.3 84.26 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.112 -1.195 . . . . 0.23 110.112 179.944 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . 0.451 HE21 ' C ' ' A' ' 83' ' ' GLY . 5.3 mm-40 -112.98 133.39 54.96 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.511 -0.994 . . . . 2.07 110.253 -179.26 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -81.47 120.02 24.47 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.583 -0.895 . . . . 1.82 108.583 178.858 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.6 m -121.76 13.01 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.857 -0.527 . . . . 0.3 110.517 -179.288 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.59 154.79 14.29 Favored Glycine 0 N--CA 1.496 2.687 0 C-N-CA 118.304 -1.903 . . . . 0.17 112.284 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -167.2 150.6 6.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.656 -0.908 . . . . 1.93 109.816 179.397 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -164.47 160.21 20.26 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 119.284 -0.966 . . . . 0.14 109.102 177.082 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.77 161.49 27.23 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.445 -0.784 . . . . 0.12 110.52 -179.055 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.433 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.51 138.91 5.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.574 -1.41 . . . . 0.12 109.574 179.16 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.05 67.17 1.7 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.269 -1.136 . . . . 0.18 109.765 -179.588 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.89 96.97 5.47 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.813 -0.81 . . . . 0.88 108.813 178.877 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . 0.4 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -70.15 -33.43 71.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.173 -0.954 . . . . 1.06 111.72 -179.55 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -62.97 -30.2 71.4 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.693 -1.255 . . . . 1.61 108.641 -179.85 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -60.61 -36.59 78.96 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.449 0.643 . . . . 1.45 109.498 -179.844 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . 0.472 HD21 ' CD1' ' A' ' 77' ' ' PHE . 39.7 mt -59.05 -37.94 78.21 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.982 0.896 . . . . 0.19 108.624 179.886 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -62.89 -42.39 99.76 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 120.128 -0.629 . . . . 2.1 110.851 -177.815 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.88 -43.47 68.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.051 -1.03 . . . . 0.19 111.655 -178.399 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -64.65 -39.95 94.58 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.701 -1.249 . . . . 0.2 110.506 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.17 -48.89 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.15 -1.055 . . . . 0.16 108.15 179.252 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.423 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.0 t-20 -60.69 -34.03 73.74 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.543 -0.91 . . . . 0.95 108.543 178.904 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -68.01 -39.29 83.21 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.669 -0.645 . . . . 2.21 110.282 -178.883 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.66 ' HB2' HD11 ' A' ' 22' ' ' LEU . 92.5 mt -100.37 -3.72 30.56 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.407 -0.808 . . . . 0.25 110.978 -178.706 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.4 p . . . . . 0 N--CA 1.495 1.803 0 O-C-N 120.552 -1.343 . . . . 1.08 108.658 -179.762 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 60.6 mmtt . . . . . 0 N--CA 1.492 1.664 0 N-CA-C 108.873 -0.788 . . . . 1.31 108.873 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.433 HD11 ' HA2' ' A' ' 91' ' ' GLY . 36.1 mm -127.97 140.69 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 N-CA-C 109.199 -0.667 . . . . 0.15 109.199 -179.954 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.5 m -97.56 122.39 40.58 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 107.165 -1.42 . . . . 0.19 107.165 177.558 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.2 m -77.79 140.3 39.42 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.85 -1.156 . . . . 0.2 111.851 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.416 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.3 m95 -74.7 -11.98 60.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -0.9 . . . . 0.21 109.685 179.236 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . 0.414 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.5 m120 . . . . . 0 N--CA 1.491 1.617 0 O-C-N 121.134 -0.979 . . . . 0.49 108.546 179.826 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.2 tptt . . . . . 0 N--CA 1.495 1.779 0 N-CA-C 108.372 -0.973 . . . . 1.67 108.372 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -96.63 122.79 39.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.239 -0.913 . . . . 0.31 108.856 -179.876 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.7 mm -100.62 111.55 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.19 108.678 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.448 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.2 mp0 -96.55 0.5 50.18 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.15 -0.969 . . . . 2.25 109.884 -179.421 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.1 p -154.13 156.12 36.63 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.026 -1.046 . . . . 0.15 111.04 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -64.74 -33.29 75.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.438 -0.949 . . . . 1.65 108.438 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 51.6 m -57.38 -46.31 83.55 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.48 -0.933 . . . . 0.23 108.48 -179.136 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 -31.85 70.37 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.903 -0.777 . . . . 0.17 108.903 178.689 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CE2' HD11 ' A' ' 15' ' ' LEU . 51.4 t80 -58.52 -43.73 89.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.304 -0.873 . . . . 0.14 109.046 -179.527 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -66.21 -42.76 88.29 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.529 -0.868 . . . . 1.31 108.891 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -63.63 -39.51 94.53 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.644 -0.66 . . . . 1.77 110.82 179.752 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.96 82.59 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.154 -0.966 . . . . 0.15 109.24 -179.659 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.508 HD11 ' CE2' ' A' ' 11' ' ' PHE . 79.7 mt -61.09 -40.15 92.63 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.087 -1.079 . . . . 0.17 108.087 179.218 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.04 -37.13 78.41 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.769 -0.582 . . . . 1.07 110.513 179.72 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.09 -36.03 79.13 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.146 -0.971 . . . . 0.18 110.27 -178.924 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.7 72.55 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.078 -1.014 . . . . 0.17 109.09 179.827 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.66 -124.02 23.45 Favored Glycine 0 N--CA 1.484 1.9 0 N-CA-C 109.417 -1.473 . . . . 0.2 109.417 -179.853 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -92.14 3.89 54.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.242 -1.152 . . . . 1.07 110.983 -179.301 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -75.8 148.71 38.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.751 -1.218 . . . . 1.5 109.118 -179.914 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.683 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.7 158.56 12.45 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 107.137 -1.431 . . . . 0.47 107.137 179.759 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.639 ' H ' HD23 ' A' ' 22' ' ' LEU . 44.1 t -146.24 119.2 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 120.651 -1.281 . . . . 0.17 108.732 179.654 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.439 HG22 ' CE2' ' A' ' 79' ' ' PHE . 21.5 t -106.52 140.99 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.664 -1.236 . . . . 0.14 107.664 179.045 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.6 t -123.54 121.95 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.439 -0.788 . . . . 0.13 109.483 -179.075 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -100.14 120.26 39.6 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.493 -0.754 . . . . 1.05 109.919 179.883 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 23.31 7.16 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.257 -0.902 . . . . 0.73 110.137 179.507 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . 0.464 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.0 m -57.43 146.26 30.08 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.032 -1.043 . . . . 0.3 110.639 -178.731 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.602 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.47 124.76 31.71 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 107.709 -1.219 . . . . 0.22 107.709 178.991 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -67.9 -33.59 75.0 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 118.657 -1.217 . . . . 0.3 108.453 -179.627 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.602 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 52.5 p-90 -70.04 -24.16 63.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.289 -0.882 . . . . 0.26 110.944 179.488 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.2 t -83.44 119.75 25.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.86 -1.15 . . . . 0.26 107.994 -179.456 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.449 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.58 -52.15 52.94 Favored Glycine 0 N--CA 1.49 2.241 0 C-N-CA 120.397 -0.906 . . . . 0.23 110.883 -178.383 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.9 Cg_exo -52.06 -37.39 68.35 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 CA-C-N 118.571 1.185 . . . . 0.31 112.635 179.59 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.38 -51.45 10.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.304 -0.873 . . . . 0.24 109.831 -179.808 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -60.07 -35.44 75.16 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.216 -0.928 . . . . 1.59 109.706 179.678 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.499 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.39 -27.74 66.27 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.502 -0.749 . . . . 2.1 109.789 -179.726 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 38' ' ' ILE . 59.9 mt -87.86 -0.84 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.644 -0.66 . . . . 0.49 111.157 -178.786 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.583 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 1.5 ptmt -64.84 -31.36 5.4 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.299 -1.501 . . . . 0.8 112.904 -178.69 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.6 Cg_exo -56.42 -39.4 91.55 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 CA-C-N 121.026 1.402 . . . . 0.28 113.277 -177.767 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -67.99 -47.23 69.12 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.279 -1.369 . . . . 0.37 108.292 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -60.14 -53.0 62.95 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.778 0.799 . . . . 0.16 110.155 178.805 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -68.63 -40.3 80.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.72 -0.613 . . . . 0.32 111.188 -179.42 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.422 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 67.1 m -62.62 -40.02 95.67 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.958 -1.089 . . . . 0.22 110.769 -179.45 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -63.12 -20.87 65.77 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.307 -0.871 . . . . 0.22 110.371 -178.493 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -52.08 -39.82 60.27 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 120.759 -1.213 . . . . 0.16 108.718 -178.982 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -82.74 -17.83 42.9 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.231 -0.918 . . . . 2.16 109.596 179.246 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -76.81 -35.99 57.23 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.675 -1.266 . . . . 1.78 107.816 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -123.37 67.98 1.0 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 106.564 -1.643 . . . . 0.25 106.564 177.445 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -10.44 15.33 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.934 -0.765 . . . . 0.22 108.934 -179.265 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -89.83 8.25 32.95 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.869 -0.789 . . . . 1.13 108.869 179.481 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.7 t -126.64 147.26 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 107.539 -1.282 . . . . 0.24 107.539 178.617 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -100.27 123.45 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.015 -1.053 . . . . 0.15 109.342 -178.658 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.539 ' C ' HD12 ' A' ' 55' ' ' LEU . 59.3 m-85 -106.09 123.96 48.83 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.136 -0.977 . . . . 0.12 109.689 179.569 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.539 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -110.0 140.16 44.31 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.077 -1.014 . . . . 0.22 109.652 178.936 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -109.93 131.45 55.05 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 106.942 -1.503 . . . . 1.13 106.942 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.79 135.25 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.428 -0.795 . . . . 0.15 110.576 -177.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . 0.639 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 53.8 t0 -97.49 119.71 36.53 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.19 -1.041 . . . . 1.05 108.19 179.186 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -68.38 -18.47 23.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.635 -1.291 . . . . 0.16 108.672 179.693 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.3 -40.76 10.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.384 -0.823 . . . . 1.08 111.505 -178.764 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.28 -13.69 23.18 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.717 -1.24 . . . . 1.07 108.106 179.516 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -125.59 37.83 4.29 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.426 -1.324 . . . . 0.14 107.426 179.164 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -59.7 -23.67 63.32 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.812 -0.81 . . . . 1.47 108.812 -178.757 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.2 p30 -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.979 -1.076 . . . . 1.05 108.757 178.811 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.469 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 4.5 t -71.18 -46.88 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 CA-C-O 121.619 0.723 . . . . 0.35 109.88 179.873 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.48 -37.14 68.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.668 -0.645 . . . . 0.26 110.597 -178.643 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -60.09 -37.43 79.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.154 -0.967 . . . . 0.24 109.466 -179.293 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.28 -33.92 76.83 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.401 -0.812 . . . . 2.06 109.099 179.163 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . 0.496 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.92 0.45 53.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.504 -0.747 . . . . 0.23 110.402 -179.34 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.7 mp0 53.14 50.05 18.63 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 2.02 110.379 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.4 t -67.99 134.41 30.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 O-C-N 120.59 -1.319 . . . . 0.16 108.74 -179.897 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -105.21 -12.94 15.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.548 -0.72 . . . . 1.6 109.844 -179.609 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.511 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.96 158.22 19.42 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.925 -1.11 . . . . 0.14 110.584 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 36.9 p -129.94 155.29 80.82 Favored Pre-proline 0 N--CA 1.502 2.169 0 N-CA-C 108.494 -0.928 . . . . 0.15 108.494 179.248 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -75.14 140.15 65.57 Favored 'Cis proline' 0 N--CA 1.497 1.734 0 C-N-CA 123.871 -1.304 . . . . 0.16 113.157 -2.112 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 90.0 m -125.39 130.34 51.69 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.263 -1.014 . . . . 0.13 108.263 178.163 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 91.9 m-85 -109.16 131.16 55.33 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 108.669 -0.863 . . . . 0.2 108.669 -179.529 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . 0.496 HE22 ' HB1' ' A' ' 69' ' ' ALA . 73.0 mt-30 -123.0 141.91 51.43 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.347 -0.845 . . . . 0.29 108.743 179.764 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . 0.439 ' CE2' HG22 ' A' ' 24' ' ' VAL . 71.8 m-85 -108.1 135.12 49.99 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.558 0.694 . . . . 0.14 110.741 -179.001 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -129.87 143.57 50.87 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.125 -0.695 . . . . 0.15 109.125 179.253 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -147.19 130.98 17.0 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 107.167 -1.42 . . . . 1.68 107.167 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 70.5 mttt 58.83 26.1 14.39 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.697 -0.853 . . . . 1.22 108.697 -178.403 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.15 22.13 71.83 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.949 -1.26 . . . . 0.23 109.949 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -129.71 141.52 50.88 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.356 -1.085 . . . . 2.07 110.406 -179.845 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -79.39 125.47 29.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.271 -0.893 . . . . 1.82 109.466 179.664 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 m -123.66 11.24 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.763 -0.586 . . . . 0.3 110.296 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.51 157.98 20.87 Favored Glycine 0 N--CA 1.497 2.701 0 C-N-CA 118.602 -1.761 . . . . 0.17 111.523 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . 0.472 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.1 tp10 -167.23 148.64 5.75 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.775 -0.838 . . . . 1.93 109.146 179.578 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.472 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.5 p90 -169.28 156.93 7.23 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.504 -0.748 . . . . 0.14 109.936 178.108 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.3 p -126.48 163.63 22.92 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.484 -0.76 . . . . 0.12 109.646 -179.588 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.481 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.85 142.48 6.69 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.324 -1.511 . . . . 0.12 109.324 179.836 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . 0.459 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.68 65.67 3.22 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.316 -1.108 . . . . 0.18 110.1 -179.542 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.04 96.03 5.06 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.367 -0.975 . . . . 0.88 108.367 178.653 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -32.34 72.25 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 1.06 111.373 -179.287 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.36 -30.05 70.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.829 -1.17 . . . . 1.61 109.765 -179.566 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.42 -34.19 73.59 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.07 -0.715 . . . . 1.45 109.07 -179.035 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.91 -39.38 85.2 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.158 0.98 . . . . 0.19 108.571 179.226 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -60.68 -44.02 97.0 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 120.174 -0.61 . . . . 2.1 110.826 -178.324 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.62 -44.02 71.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.19 111.603 -178.203 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.0 m -64.0 -39.92 95.19 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 120.853 -1.154 . . . . 0.2 109.683 -178.864 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.84 -49.48 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 N-CA-C 108.077 -1.083 . . . . 0.16 108.077 178.876 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.519 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.2 t-20 -60.18 -35.23 74.9 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.257 -1.016 . . . . 0.95 108.257 179.166 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -68.0 -40.07 83.09 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.436 -0.79 . . . . 2.21 110.616 -179.188 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.683 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.4 mt -98.78 -3.44 35.61 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.232 -0.917 . . . . 0.25 111.185 -178.533 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.519 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.5 p . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.589 -1.319 . . . . 1.08 109.105 -179.758 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt . . . . . 0 N--CA 1.493 1.705 0 N-CA-C 109.692 -0.484 . . . . 1.31 109.692 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.481 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.8 mm -130.02 142.01 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.677 -0.639 . . . . 0.15 109.856 -179.208 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.5 m -101.27 129.28 47.21 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.538 -1.282 . . . . 0.19 107.538 177.961 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 58.5 m -78.72 140.61 38.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.851 -1.156 . . . . 0.2 110.644 -178.897 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . 0.411 ' NE1' HG23 ' A' ' 74' ' ' THR . 18.5 m95 -76.15 -10.11 59.16 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.801 -1.187 . . . . 0.21 109.566 178.972 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 . . . . . 0 C--N 1.303 -1.453 0 O-C-N 121.184 -0.947 . . . . 0.49 108.558 -179.683 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 tptp . . . . . 0 N--CA 1.496 1.86 0 N-CA-C 108.524 -0.917 . . . . 1.67 108.524 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -97.66 124.33 41.92 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.177 -0.952 . . . . 0.31 108.699 179.679 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -103.27 113.81 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 N-CA-C 108.787 -0.82 . . . . 0.19 108.787 179.426 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.417 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.3 mp0 -96.09 -1.05 49.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.993 . . . . 2.25 110.092 -179.463 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -155.49 156.66 35.63 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.885 -1.135 . . . . 0.15 111.376 -179.816 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 8' ' ' LYS . . . . . 0.725 ' HZ1' ' HB2' ' A' ' 68' ' ' GLU . 14.5 ttmm -64.08 -31.96 73.35 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.456 -0.942 . . . . 1.65 108.456 178.658 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.0 m -56.72 -49.07 76.27 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.276 -0.97 . . . . 0.23 108.559 -179.478 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -30.72 69.01 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.48 -0.763 . . . . 0.17 109.21 178.782 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 11' ' ' PHE . . . . . 0.491 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.5 t80 -59.67 -42.53 93.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.14 108.875 -179.354 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -65.77 -42.5 90.77 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.31 -0.996 . . . . 1.31 108.31 179.533 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -64.27 -37.33 87.09 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.285 0.564 . . . . 1.77 110.173 179.497 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.95 77.75 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.266 -0.896 . . . . 0.15 108.986 -179.477 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 15' ' ' LEU . . . . . 0.491 HD11 ' CE2' ' A' ' 11' ' ' PHE . 54.6 mt -60.72 -40.79 93.66 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.516 -0.873 . . . . 0.17 108.668 179.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -68.66 -38.1 80.15 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 1.07 110.238 179.573 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.81 -37.31 84.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.347 -0.845 . . . . 0.18 110.201 -178.694 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.83 73.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.026 -1.046 . . . . 0.17 109.385 179.893 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -124.48 22.48 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.897 -1.281 . . . . 0.2 109.897 -179.6 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.24 4.48 52.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.398 -1.06 . . . . 1.07 110.149 -179.206 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -75.79 147.74 38.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.973 -1.079 . . . . 1.5 108.848 -179.673 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.716 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.51 159.56 6.3 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 107.387 -1.338 . . . . 0.47 107.387 -179.392 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild core ' A' A ' 23' ' ' VAL . . . . . 0.716 ' H ' HD23 ' A' ' 22' ' ' LEU . 67.1 t -148.48 118.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 120.964 -1.085 . . . . 0.17 108.097 179.578 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 t -106.48 142.73 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.912 -1.144 . . . . 0.14 107.912 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.0 t -125.92 122.46 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.414 -0.804 . . . . 0.13 109.82 -178.76 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -99.09 118.85 36.77 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.303 -0.873 . . . . 1.05 109.456 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -94.79 20.49 8.66 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.155 -0.966 . . . . 0.73 109.285 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -55.94 147.87 18.56 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 120.974 -1.079 . . . . 0.3 110.276 -178.623 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 29' ' ' ALA . . . . . 0.713 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.51 126.03 32.93 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.398 -1.334 . . . . 0.22 107.398 178.61 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -69.07 -32.02 71.17 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.661 -1.215 . . . . 0.3 107.829 179.395 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 31' ' ' TRP . . . . . 0.713 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 62.8 p-90 -70.42 -22.42 62.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.69 -0.631 . . . . 0.26 110.98 179.81 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.2 t -84.74 115.33 22.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.788 -1.195 . . . . 0.26 108.239 -179.772 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 33' ' ' GLY . . . . . 0.445 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.29 -51.89 55.16 Favored Glycine 0 N--CA 1.488 2.15 0 C-N-CA 120.437 -0.887 . . . . 0.23 111.391 -178.397 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.2 Cg_exo -51.81 -35.45 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 CA-C-N 118.809 1.305 . . . . 0.31 111.325 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.98 -50.29 13.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.531 -0.731 . . . . 0.24 110.09 -179.747 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -59.81 -34.95 73.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.086 -1.009 . . . . 1.59 109.026 -179.765 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 37' ' ' MET . . . . . 0.54 ' SD ' ' O ' ' A' ' 37' ' ' MET . 10.1 tmm? -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.403 -0.81 . . . . 2.1 109.313 179.917 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 38' ' ' ILE . . . . . 0.571 HG22 ' O ' ' A' ' 38' ' ' ILE . 74.9 mt -84.95 -1.99 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.588 -0.695 . . . . 0.49 111.603 -178.938 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 39' ' ' LYS . . . . . 0.574 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 18.2 pttt -65.44 -30.11 3.82 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 120.168 -1.582 . . . . 0.8 113.26 -178.627 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 40' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.2 Cg_exo -55.08 -40.06 87.76 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 121.403 1.537 . . . . 0.28 112.533 -177.067 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.26 -45.04 74.24 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 118.367 -1.333 . . . . 0.37 108.35 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.13 -51.63 67.08 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.21 -0.931 . . . . 0.16 109.697 179.36 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -67.33 -41.84 84.59 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.524 0.678 . . . . 0.32 110.741 179.841 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 44' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.3 m -62.22 -39.94 94.44 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.273 -0.892 . . . . 0.22 110.195 -179.287 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.74 -23.14 64.72 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.344 -0.848 . . . . 0.22 110.613 -179.023 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.2 m -53.36 -35.38 60.2 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.801 -1.187 . . . . 0.16 108.849 -179.254 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.534 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.3 mp0 -88.88 -13.38 39.31 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.195 -0.941 . . . . 2.16 108.959 179.198 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -77.77 -39.97 42.37 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.814 -1.18 . . . . 1.78 107.814 178.698 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -123.87 69.6 1.06 Allowed 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.741 -1.577 . . . . 0.25 106.741 178.058 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.35 -9.07 10.41 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.543 -0.91 . . . . 0.22 108.543 -179.32 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -89.68 8.03 33.66 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.202 -1.036 . . . . 1.13 108.202 179.146 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 52' ' ' VAL . . . . . 0.47 HG13 ' HB3' ' A' ' 22' ' ' LEU . 56.0 t -126.45 142.74 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 N-CA-C 107.996 -1.113 . . . . 0.24 107.996 179.114 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 53' ' ' ILE . . . . . 0.427 HG22 ' CD1' ' A' ' 55' ' ' LEU . 30.7 mm -97.88 121.31 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.217 -0.927 . . . . 0.15 109.65 -178.995 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 54' ' ' PHE . . . . . 0.524 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.6 m-85 -101.63 125.4 48.28 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.391 -0.818 . . . . 0.12 109.385 179.551 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.524 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -110.28 144.85 38.37 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.075 -1.016 . . . . 0.22 110.097 179.14 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -112.52 131.51 55.56 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.216 -1.402 . . . . 1.13 107.216 177.825 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -128.21 132.08 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.404 -0.81 . . . . 0.15 109.744 -178.849 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -95.11 120.0 34.57 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.872 -0.788 . . . . 1.05 108.872 179.873 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -64.99 -19.84 26.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.813 0 O-C-N 120.378 -1.451 . . . . 0.16 107.876 179.199 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 60' ' ' ASP . . . . . 0.499 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 28.5 m-20 -92.64 -41.67 10.06 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.457 -0.777 . . . . 1.08 112.403 -178.746 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -95.67 -18.23 20.67 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.36 -1.463 . . . . 1.07 108.99 -179.576 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.82 40.7 3.66 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.735 -1.209 . . . . 0.14 107.735 179.029 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -60.18 -19.13 52.63 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.469 -0.567 . . . . 1.47 109.469 -179.161 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 64' ' ' ASP . . . . . 0.59 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -62.22 -39.43 92.76 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.985 -1.072 . . . . 1.05 108.849 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 65' ' ' VAL . . . . . 0.59 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.2 t -73.69 -43.98 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 O-C-N 121.274 -0.891 . . . . 0.35 109.849 -179.973 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.37 -40.57 81.39 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.396 -0.815 . . . . 0.26 110.471 -178.273 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.6 p -60.32 -39.29 86.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.048 -1.032 . . . . 0.24 109.177 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 68' ' ' GLU . . . . . 0.725 ' HB2' ' HZ1' ' A' ' 8' ' ' LYS . 40.4 tt0 -62.97 -38.99 93.34 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.337 -0.852 . . . . 2.06 109.832 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.68 -2.5 58.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.437 -0.789 . . . . 0.23 111.179 -178.416 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 56.03 49.15 16.26 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.163 -0.96 . . . . 2.02 109.947 -179.913 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.84 132.47 28.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 118.586 -1.246 . . . . 0.16 108.038 -179.617 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -105.26 -12.17 16.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.478 -0.764 . . . . 1.6 110.173 -179.039 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 73' ' ' ALA . . . . . 0.465 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.86 156.22 17.44 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.829 -1.169 . . . . 0.14 111.071 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -127.72 156.28 75.89 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 107.966 -1.124 . . . . 0.15 107.966 179.087 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -74.36 143.39 77.68 Favored 'Cis proline' 0 N--CA 1.494 1.547 0 C-N-CA 123.85 -1.312 . . . . 0.16 112.851 -3.682 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 76' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -128.24 133.7 48.87 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.492 -0.929 . . . . 0.13 108.492 177.926 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -111.46 131.69 55.03 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 108.803 -0.814 . . . . 0.2 108.803 -179.236 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -122.96 140.61 52.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.29 109.161 179.457 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -108.28 135.55 49.42 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.309 0.576 . . . . 0.14 110.448 -179.207 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -126.32 149.16 49.35 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.43 0.633 . . . . 0.15 109.434 179.341 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -146.76 126.41 13.37 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 106.964 -1.495 . . . . 1.68 106.964 -179.734 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.9 mttp 54.02 34.08 18.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.938 -1.101 . . . . 1.22 108.677 -177.987 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.64 20.71 79.72 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 110.017 -1.233 . . . . 0.23 110.017 179.568 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -124.45 133.5 53.35 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.427 -1.043 . . . . 2.07 110.611 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -78.4 124.06 27.69 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.241 -0.912 . . . . 1.82 109.732 179.657 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.4 m -123.99 10.8 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.663 -0.648 . . . . 0.3 110.522 -179.578 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.83 151.26 10.6 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 118.564 -1.779 . . . . 0.17 111.451 -179.819 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -164.92 148.01 8.48 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.815 -0.815 . . . . 1.93 109.045 179.285 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 89' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 11.1 p90 -164.19 159.03 19.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.198 -0.939 . . . . 0.14 110.025 178.16 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.24 159.98 31.56 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.58 0.705 . . . . 0.12 109.786 -179.529 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 91' ' ' GLY . . . . . 0.474 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.37 143.0 6.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.241 -1.544 . . . . 0.12 109.241 179.099 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.39 66.58 2.47 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.258 -1.142 . . . . 0.18 109.606 -179.879 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.84 92.51 3.8 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 108.175 -1.046 . . . . 0.88 108.175 178.909 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.97 -32.53 73.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.445 -0.784 . . . . 1.06 111.196 -179.093 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -63.92 -30.8 71.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.035 -1.041 . . . . 1.61 109.521 -179.619 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.36 -35.33 75.44 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 109.215 -0.661 . . . . 1.45 109.215 -179.003 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.86 -38.88 83.38 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.562 -0.903 . . . . 0.19 108.562 179.106 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.47 -43.75 98.31 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 120.261 -0.576 . . . . 2.1 110.673 -178.029 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.88 -43.81 71.07 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.211 -0.931 . . . . 0.19 111.543 -178.768 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -64.17 -39.93 95.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.868 -1.145 . . . . 0.2 110.18 -178.585 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.3 mt -61.39 -48.97 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 108.162 -1.051 . . . . 0.16 108.162 179.118 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 102' ' ' ASN . . . . . 0.51 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.1 t-20 -60.63 -34.62 74.55 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.389 -0.967 . . . . 0.95 108.389 179.448 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -68.03 -39.93 83.02 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.532 -0.73 . . . . 2.21 110.909 -178.587 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' A' A ' 104' ' ' LEU . . . . . 0.505 ' HB2' HD11 ' A' ' 22' ' ' LEU . 88.0 mt -100.17 0.22 40.09 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.108 -0.995 . . . . 0.25 111.141 -178.333 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' A' A ' 105' ' ' VAL . . . . . 0.51 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.683 -1.26 . . . . 1.08 109.464 -179.489 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 65.8 mmtt . . . . . 0 N--CA 1.487 1.413 0 N-CA-C 109.132 -0.692 . . . . 1.31 109.132 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild core ' B' B ' 64' ' ' ILE . . . . . 0.474 HD11 ' HA2' ' A' ' 91' ' ' GLY . 28.9 mm -135.85 142.43 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 N-CA-C 109.406 -0.59 . . . . 0.15 109.406 -179.649 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild core ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 9.4 m -101.71 127.2 48.58 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 107.543 -1.28 . . . . 0.19 107.543 177.634 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.1 m -78.81 139.94 38.29 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.865 -1.147 . . . . 0.2 111.562 -178.291 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 67' ' ' TRP . . . . . . . . . . . . . 24.0 m95 -72.94 -8.75 57.08 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.912 -0.773 . . . . 0.21 108.912 178.283 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild core ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 . . . . . 0 C--N 1.301 -1.516 0 N-CA-C 108.794 -0.817 . . . . 0.49 108.794 179.37 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.2 mmm . . . . . 0 N--CA 1.495 1.79 0 CA-C-O 121.219 0.533 . . . . 2.88 109.685 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.0 t -98.92 138.86 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.273 0 O-C-N 121.434 -0.791 . . . . 0.45 109.739 -179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 81.3 tttt -130.59 127.55 39.25 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 121.357 -0.839 . . . . 1.67 109.296 -179.884 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.0 tt0 -94.64 123.22 37.95 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.23 -0.919 . . . . 0.31 108.748 179.298 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.9 mm -99.87 116.47 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 N-CA-C 107.896 -1.15 . . . . 0.19 107.896 179.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.516 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 55.1 mp0 -99.48 -1.08 39.36 Favored 'General case' 0 N--CA 1.487 1.377 0 O-C-N 121.34 -0.85 . . . . 2.25 109.274 -179.97 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -155.74 156.49 34.94 Favored 'General case' 0 N--CA 1.499 1.987 0 O-C-N 120.988 -1.07 . . . . 0.15 111.481 -179.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.9 ttpt -63.34 -31.45 72.61 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.332 -0.988 . . . . 1.65 108.332 178.576 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 87.1 m -59.51 -47.52 85.22 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 108.729 -0.841 . . . . 0.23 108.729 -179.845 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.97 -30.5 69.8 Favored 'General case' 0 C--N 1.297 -1.703 0 O-C-N 121.381 -0.825 . . . . 0.17 108.909 178.914 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.477 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.5 t80 -59.81 -41.42 91.21 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.378 -0.826 . . . . 0.14 109.276 -179.866 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.3 mm100 -66.78 -41.88 86.97 Favored 'General case' 0 C--N 1.296 -1.757 0 N-CA-C 108.769 -0.826 . . . . 1.31 108.769 -179.901 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.535 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.27 -40.45 93.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.825 -0.547 . . . . 1.77 110.686 179.606 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.9 -39.27 87.38 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 121.244 -0.91 . . . . 0.15 109.278 -179.347 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.477 HD11 ' CE2' ' A' ' 11' ' ' PHE . 70.8 mt -61.71 -39.95 93.33 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.868 -1.145 . . . . 0.17 108.574 179.694 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.99 -35.32 74.32 Favored 'General case' 0 C--N 1.305 -1.369 0 O-C-N 121.641 -0.662 . . . . 1.07 109.945 -179.85 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.1 -36.48 79.84 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 121.24 -0.912 . . . . 0.18 109.901 -179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.4 -33.06 74.72 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.311 -0.868 . . . . 0.17 109.455 -179.83 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.92 -127.28 24.82 Favored Glycine 0 N--CA 1.485 1.929 0 N-CA-C 109.583 -1.407 . . . . 0.2 109.583 -179.614 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.446 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 69.2 m-20 -90.02 2.17 55.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.061 -1.258 . . . . 1.07 110.456 -178.805 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.4 mttm -75.22 150.09 38.72 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 120.906 -1.121 . . . . 1.5 110.171 -179.213 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.658 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.6 155.21 15.96 Favored 'General case' 0 N--CA 1.488 1.429 0 N-CA-C 107.395 -1.335 . . . . 0.47 107.395 179.966 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.656 ' H ' HD23 ' A' ' 22' ' ' LEU . 89.5 t -142.38 110.43 2.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.599 0 O-C-N 121.187 -0.946 . . . . 0.17 108.954 179.983 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 16.1 t -97.37 142.58 14.0 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.725 0 N-CA-C 108.28 -1.007 . . . . 0.14 108.28 179.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.1 t -124.48 124.61 68.7 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.187 0 O-C-N 121.191 -0.943 . . . . 0.13 109.49 -179.504 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.531 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -101.97 118.17 36.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 121.488 -0.757 . . . . 1.05 109.963 179.515 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.487 ' CE2' ' NE2' ' A' ' 78' ' ' GLN . 67.0 m-85 -95.8 21.63 8.28 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.288 -0.882 . . . . 0.73 109.531 179.046 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 50.4 m -57.5 148.59 23.3 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 120.926 -1.109 . . . . 0.3 110.697 -178.883 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.668 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.04 123.93 32.66 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.054 -1.091 . . . . 0.22 108.054 178.783 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.6 t -67.94 -31.38 71.1 Favored 'General case' 0 C--N 1.301 -1.54 0 C-N-CA 118.783 -1.167 . . . . 0.3 108.303 179.583 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.668 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.9 p-90 -71.05 -24.27 62.31 Favored 'General case' 0 N--CA 1.494 1.729 0 O-C-N 121.578 -0.701 . . . . 0.26 110.645 179.901 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -85.18 119.31 25.42 Favored 'General case' 0 N--CA 1.491 1.6 0 O-C-N 120.942 -1.098 . . . . 0.26 108.101 -179.898 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.438 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.31 -53.22 47.37 Favored Glycine 0 N--CA 1.493 2.442 0 N-CA-C 111.134 -0.786 . . . . 0.23 111.134 -178.404 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.438 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.6 Cg_exo -53.05 -37.16 78.68 Favored 'Trans proline' 0 C--N 1.308 -1.603 0 CA-C-N 118.515 1.158 . . . . 0.31 112.344 179.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.95 -54.6 6.63 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 121.487 -0.758 . . . . 0.24 110.083 -179.287 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.1 tttt -59.84 -36.74 77.46 Favored 'General case' 0 N--CA 1.492 1.659 0 O-C-N 121.01 -1.056 . . . . 1.59 109.813 179.816 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.513 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.11 -29.73 67.59 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.423 -0.798 . . . . 2.1 110.244 -178.823 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.62 HG22 ' O ' ' A' ' 38' ' ' ILE . 52.3 mt -83.89 0.45 4.87 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 O-C-N 121.439 -0.788 . . . . 0.49 110.999 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.566 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 12.9 ptmt -68.03 -28.52 1.89 Allowed Pre-proline 0 N--CA 1.495 1.793 0 O-C-N 120.57 -1.331 . . . . 0.8 113.406 -178.454 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.566 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.3 Cg_exo -53.03 -39.61 79.06 Favored 'Trans proline' 0 N--CA 1.496 1.628 0 CA-C-N 121.857 1.699 . . . . 0.28 112.92 -176.8 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -69.13 -45.17 70.78 Favored 'General case' 0 C--N 1.296 -1.747 0 C-N-CA 118.438 -1.305 . . . . 0.37 108.735 178.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -60.21 -52.97 63.05 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.132 -0.98 . . . . 0.16 109.694 178.942 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 48.8 t60 -68.71 -44.25 74.28 Favored 'General case' 0 N--CA 1.495 1.8 0 O-C-N 121.623 -0.673 . . . . 0.32 110.726 179.567 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.448 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 54.4 m -60.64 -39.7 89.26 Favored 'General case' 0 N--CA 1.503 2.189 0 O-C-N 121.059 -1.026 . . . . 0.22 111.186 -179.306 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -64.53 -19.65 65.73 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.963 -1.086 . . . . 0.22 110.945 -177.716 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -49.87 -39.84 40.68 Favored 'General case' 0 C--N 1.299 -1.606 0 O-C-N 120.902 -1.124 . . . . 0.16 108.66 -178.754 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 -84.53 -13.82 50.74 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 120.69 -1.257 . . . . 2.16 109.485 178.753 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.1 tptm -76.44 -36.29 58.04 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 107.613 -1.254 . . . . 1.78 107.613 179.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 89.9 m-85 -125.85 68.88 1.18 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.023 -1.473 . . . . 0.25 107.023 177.808 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -64.28 -7.95 11.16 Favored 'General case' 0 C--N 1.307 -1.261 0 O-C-N 121.509 -0.745 . . . . 0.22 109.113 -179.005 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.1 t30 -91.48 8.99 33.74 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 107.898 -1.149 . . . . 1.13 107.898 178.55 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 38.8 t -128.0 141.82 45.41 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 N-CA-C 107.875 -1.157 . . . . 0.24 107.875 178.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -99.62 121.55 50.41 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.097 0 O-C-N 121.189 -0.945 . . . . 0.15 109.708 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.513 ' C ' HD12 ' A' ' 55' ' ' LEU . 40.7 m-85 -101.19 127.51 47.72 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.272 -0.893 . . . . 0.12 109.869 179.82 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.513 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -109.89 141.03 43.18 Favored 'General case' 0 N--CA 1.503 2.196 0 O-C-N 121.306 -0.871 . . . . 0.22 108.812 179.125 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.2 tt0 -109.51 131.24 55.25 Favored 'General case' 0 N--CA 1.49 1.557 0 N-CA-C 106.677 -1.601 . . . . 1.13 106.677 177.731 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -128.67 131.99 68.12 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.438 -0.789 . . . . 0.15 110.638 -177.976 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.615 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 40.2 t0 -96.01 120.12 35.73 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 108.828 -0.804 . . . . 1.05 108.828 179.746 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 30.5 m -67.89 -19.03 24.42 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.694 0 O-C-N 120.456 -1.402 . . . . 0.16 108.513 179.286 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.492 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 12.0 m-20 -92.58 -44.22 8.72 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.377 -0.827 . . . . 1.08 111.529 -179.531 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.429 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 69.4 m-20 -94.23 -15.16 24.81 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.757 -1.214 . . . . 1.07 108.259 179.98 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.615 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.88 4.09 Favored 'General case' 0 N--CA 1.494 1.767 0 N-CA-C 108.023 -1.102 . . . . 0.14 108.023 179.886 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.5 pt20 -60.09 -26.54 66.28 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.59 -0.694 . . . . 1.47 110.35 -178.499 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.513 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -64.1 -37.91 89.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 120.785 -1.197 . . . . 1.05 108.952 179.561 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.513 HG23 ' OD1' ' A' ' 64' ' ' ASP . 4.4 t -70.31 -44.24 77.74 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.402 0 O-C-N 121.275 -0.891 . . . . 0.35 109.249 179.782 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.8 -40.31 76.03 Favored 'General case' 0 N--CA 1.487 1.389 0 O-C-N 121.763 -0.586 . . . . 0.26 110.341 -178.782 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.7 p -61.14 -33.59 73.64 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 121.199 -0.938 . . . . 0.24 109.222 -179.66 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.8 tt0 -60.36 -39.58 87.69 Favored 'General case' 0 N--CA 1.487 1.414 0 O-C-N 121.254 -0.904 . . . . 2.06 108.791 179.107 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.465 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -89.82 -1.49 58.0 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.349 -0.844 . . . . 0.23 110.913 -179.205 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.2 mm-40 55.68 49.92 15.39 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.183 -0.948 . . . . 2.02 109.605 -179.185 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.7 t -61.52 128.9 23.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.528 0 O-C-N 120.663 -1.273 . . . . 0.16 109.021 -178.667 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -101.34 -10.91 19.85 Favored 'General case' 0 N--CA 1.487 1.379 0 O-C-N 121.712 -0.618 . . . . 1.6 110.045 -179.134 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.474 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.61 155.99 17.8 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 120.689 -1.257 . . . . 0.14 110.459 179.098 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 33.9 p -129.22 154.05 80.51 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.075 -1.083 . . . . 0.15 108.075 178.693 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo -75.53 141.65 71.79 Favored 'Cis proline' 0 N--CA 1.495 1.595 0 C-N-CA 123.862 -1.307 . . . . 0.16 113.148 -1.932 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.474 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.75 131.61 47.87 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.544 -0.91 . . . . 0.13 108.544 178.118 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.531 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.6 m-85 -108.82 130.65 55.4 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 109.001 -0.74 . . . . 0.2 109.001 -178.978 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.487 ' NE2' ' CE2' ' A' ' 27' ' ' PHE . 70.9 mt-30 -122.81 140.48 52.88 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.247 -0.908 . . . . 0.29 108.601 179.45 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.404 ' CE1' HG21 ' A' ' 100' ' ' THR . 74.2 m-85 -107.78 136.03 48.19 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.762 -0.586 . . . . 0.14 110.228 -179.012 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 66.7 m-85 -127.1 149.22 50.04 Favored 'General case' 0 N--CA 1.488 1.464 0 N-CA-C 109.023 -0.732 . . . . 0.15 109.023 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.6 ttmt -145.77 120.48 9.85 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 107.772 -1.196 . . . . 1.68 107.772 -179.545 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.446 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 52.8 mttm 59.38 30.73 20.48 Favored 'General case' 0 N--CA 1.487 1.379 0 N-CA-C 107.629 -1.248 . . . . 1.22 107.629 -178.237 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.21 15.79 81.17 Favored Glycine 0 N--CA 1.491 2.33 0 N-CA-C 109.654 -1.378 . . . . 0.23 109.654 -179.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 6.0 mm-40 -114.53 131.64 56.59 Favored 'General case' 0 N--CA 1.504 2.266 0 O-C-N 121.461 -1.023 . . . . 2.07 110.574 -179.498 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -77.93 120.13 22.36 Favored 'General case' 0 N--CA 1.502 2.147 0 O-C-N 121.211 -0.93 . . . . 1.82 108.913 178.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.9 m -122.85 12.45 5.49 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.512 -0.742 . . . . 0.3 111.025 -179.611 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.82 151.17 9.36 Favored Glycine 0 N--CA 1.49 2.297 0 C-N-CA 118.445 -1.836 . . . . 0.17 110.992 179.854 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.5 tm-20 -164.34 149.57 10.24 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.833 -0.804 . . . . 1.93 109.207 179.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.432 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 13.1 p90 -164.04 160.14 21.4 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 119.063 -1.055 . . . . 0.14 109.338 177.59 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.24 161.72 27.08 Favored 'General case' 0 N--CA 1.497 1.921 0 CA-C-O 121.49 0.662 . . . . 0.12 109.749 -179.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.456 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.98 141.04 5.82 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 109.542 -1.423 . . . . 0.12 109.542 179.286 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.496 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.06 66.4 2.23 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.229 -1.16 . . . . 0.18 109.903 -179.526 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.11 94.21 4.31 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 121.51 -0.744 . . . . 0.88 109.51 178.609 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.77 -31.64 72.4 Favored 'General case' 0 N--CA 1.497 1.906 0 O-C-N 121.062 -1.024 . . . . 1.06 111.539 -179.71 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 75.6 mm-40 -65.99 -30.37 70.91 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 120.612 -1.305 . . . . 1.61 109.806 -179.668 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.0 tttt -59.92 -34.33 73.06 Favored 'General case' 0 C--N 1.298 -1.662 0 CA-C-O 121.627 0.727 . . . . 1.45 109.837 -179.254 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 43.5 mt -59.59 -39.09 83.01 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 122.046 0.927 . . . . 0.19 108.693 179.309 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.42 -44.19 97.04 Favored 'General case' 0 C--N 1.296 -1.751 0 C-N-CA 120.111 -0.636 . . . . 2.1 110.4 -178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.57 -43.29 69.74 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.22 -0.925 . . . . 0.19 111.365 -179.105 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.404 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.6 m -64.56 -40.37 95.45 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.978 -1.076 . . . . 0.2 108.939 -178.717 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.6 mt -61.29 -46.08 97.32 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 106.843 -1.54 . . . . 0.16 106.843 178.011 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.5 ' O ' HG12 ' A' ' 105' ' ' VAL . 16.9 t-20 -60.48 -35.82 76.82 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 108.748 -0.834 . . . . 0.95 108.748 178.392 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 7.8 tm-20 -68.57 -39.95 80.79 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.547 -0.721 . . . . 2.21 110.111 -178.777 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.658 ' HB2' HD11 ' A' ' 22' ' ' LEU . 80.2 mt -98.96 -0.09 42.88 Favored 'General case' 0 N--CA 1.503 2.207 0 O-C-N 121.107 -0.995 . . . . 0.25 111.624 -178.624 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.5 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.496 1.862 0 O-C-N 120.619 -1.3 . . . . 1.08 109.682 -179.51 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 72.7 Cg_endo . . . . . 0 N--CA 1.492 1.385 0 CA-C-O 121.186 0.411 . . . . 1.46 111.987 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -101.39 119.19 38.39 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.303 -0.873 . . . . 0.88 108.664 179.332 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.45 HG22 ' H ' ' B' ' 63' ' ' LYS . 22.1 m -108.19 128.6 54.85 Favored 'General case' 0 N--CA 1.498 1.967 0 O-C-N 121.333 -0.854 . . . . 0.7 108.988 -179.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 79.5 mt -63.01 -29.46 70.84 Favored 'General case' 0 N--CA 1.492 1.65 0 O-C-N 121.119 -0.988 . . . . 0.61 109.404 179.915 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.45 ' H ' HG22 ' B' ' 61' ' ' THR . 47.9 mmtm -67.81 -16.95 64.35 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.568 -0.708 . . . . 1.31 109.509 -179.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.456 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.9 mm -128.99 141.19 47.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.737 -0.602 . . . . 0.15 109.844 -179.189 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.4 m -100.48 128.47 46.53 Favored 'General case' 0 N--CA 1.501 2.087 0 N-CA-C 106.616 -1.624 . . . . 0.19 106.616 177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -82.37 143.01 31.53 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.72 -1.238 . . . . 0.2 111.724 -178.086 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.442 ' C ' ' N ' ' B' ' 69' ' ' VAL . 25.1 m95 -76.25 -13.31 60.17 Favored 'General case' 0 N--CA 1.497 1.878 0 O-C-N 121.565 -0.709 . . . . 0.21 109.33 179.643 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -55.2 -11.58 0.77 Allowed 'General case' 0 N--CA 1.49 1.538 0 N-CA-C 107.865 -1.161 . . . . 0.49 107.865 179.852 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.442 ' N ' ' C ' ' B' ' 67' ' ' TRP . 31.2 m -66.71 140.31 19.66 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.356 0 N-CA-C 109.313 -0.625 . . . . 1.04 109.313 179.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 74.8 m-20 -59.96 -39.51 85.85 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.313 -0.867 . . . . 1.36 109.245 -179.99 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.118 -1.593 . . . . 2.32 109.118 179.537 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.4 ptt? . . . . . 0 N--CA 1.492 1.638 0 CA-C-O 121.149 0.5 . . . . 2.88 109.756 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 55.3 t -99.65 142.6 14.93 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.332 0 O-C-N 121.235 -0.915 . . . . 0.45 109.292 -179.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.1 tttp -130.84 127.16 38.04 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.182 -0.949 . . . . 1.67 109.476 179.824 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.6 tt0 -95.27 124.73 39.47 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.242 -0.911 . . . . 0.31 109.301 179.579 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.4 mm -101.47 116.39 44.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.583 0 N-CA-C 108.288 -1.004 . . . . 0.19 108.288 179.473 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 58.0 mm-40 -98.55 -3.54 36.16 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.009 -1.057 . . . . 2.25 109.721 179.748 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -152.26 159.93 43.44 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.863 -1.148 . . . . 0.15 110.975 -179.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.8 ttmt -63.98 -34.33 77.75 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.83 -1.174 . . . . 1.65 107.83 178.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 91.6 m -56.61 -46.22 81.01 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 108.49 -0.929 . . . . 0.23 108.49 -179.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.56 -31.0 68.92 Favored 'General case' 0 C--N 1.299 -1.626 0 N-CA-C 108.652 -0.87 . . . . 0.17 108.652 178.774 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.537 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.5 t80 -60.03 -43.3 95.4 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.105 -0.997 . . . . 0.14 108.936 -179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.2 mm100 -66.56 -43.19 85.72 Favored 'General case' 0 C--N 1.295 -1.774 0 N-CA-C 108.915 -0.772 . . . . 1.31 108.915 -179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -62.49 -40.72 97.59 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.583 -0.698 . . . . 1.77 110.622 179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.11 -40.33 86.84 Favored 'General case' 0 N--CA 1.486 1.354 0 O-C-N 120.85 -1.157 . . . . 0.15 108.684 -179.607 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.537 HD11 ' CE2' ' A' ' 11' ' ' PHE . 79.8 mt -60.76 -40.86 94.03 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.869 -1.132 . . . . 0.17 108.203 179.516 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 38.6 t0 -70.08 -34.5 73.23 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.318 -0.864 . . . . 1.07 109.592 179.326 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.2 -37.8 75.18 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.643 -0.661 . . . . 0.18 110.202 -179.066 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.15 -31.09 71.53 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.185 -0.947 . . . . 0.17 109.71 -179.674 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.78 -127.57 25.51 Favored Glycine 0 N--CA 1.494 2.504 0 N-CA-C 110.455 -1.058 . . . . 0.2 110.455 179.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.0 m-20 -90.79 2.42 56.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.918 -1.342 . . . . 1.07 110.307 -178.991 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.5 mttt -74.05 150.69 40.47 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.005 -1.059 . . . . 1.5 110.011 -179.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.649 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.29 156.45 15.57 Favored 'General case' 0 C--N 1.307 -1.266 0 N-CA-C 107.287 -1.375 . . . . 0.47 107.287 179.948 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.649 ' H ' HD23 ' A' ' 22' ' ' LEU . 65.6 t -143.97 111.54 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.75 -1.219 . . . . 0.17 109.483 -179.722 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.4 t -100.69 141.47 17.43 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.445 0 N-CA-C 108.046 -1.094 . . . . 0.14 108.046 179.544 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.9 t -124.64 121.51 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.307 -0.871 . . . . 0.13 109.622 -179.114 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 45.2 t0 -98.71 121.13 40.26 Favored 'General case' 0 N--CA 1.501 2.092 0 O-C-N 121.307 -0.871 . . . . 1.05 109.917 179.319 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.24 19.69 11.51 Favored 'General case' 0 N--CA 1.506 2.332 0 O-C-N 120.963 -1.086 . . . . 0.73 110.129 179.512 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.443 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.2 m -54.3 143.29 23.7 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.047 -1.033 . . . . 0.3 110.595 -178.486 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.506 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -81.0 129.43 34.53 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.031 -1.1 . . . . 0.22 108.031 179.018 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.6 t -68.62 -32.29 72.06 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 120.987 -1.07 . . . . 0.3 108.997 -179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.509 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 54.4 p-90 -73.59 -21.54 60.3 Favored 'General case' 0 N--CA 1.489 1.496 0 C-N-CA 119.598 -0.841 . . . . 0.26 110.803 -179.582 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.8 t -84.66 113.14 21.07 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.099 -1.001 . . . . 0.26 108.594 -179.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.435 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.26 -51.99 55.41 Favored Glycine 0 N--CA 1.486 2.007 0 C-N-CA 120.698 -0.763 . . . . 0.23 111.334 -178.721 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.435 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 33.0 Cg_exo -50.31 -36.31 46.89 Favored 'Trans proline' 0 C--N 1.31 -1.454 0 CA-C-N 119.002 1.401 . . . . 0.31 112.056 179.861 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.443 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.88 -46.19 19.06 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.39 -0.818 . . . . 0.24 109.148 179.504 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt -59.28 -32.9 70.46 Favored 'General case' 0 N--CA 1.489 1.488 0 O-C-N 121.08 -1.013 . . . . 1.59 109.003 179.619 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.467 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.1 tmm? -59.15 -27.75 65.94 Favored 'General case' 0 C--N 1.298 -1.646 0 O-C-N 121.635 -0.666 . . . . 2.1 110.133 -179.815 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.8 mt -83.58 -5.9 9.69 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.891 0 O-C-N 121.492 -0.755 . . . . 0.49 110.952 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.545 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.15 -31.56 9.56 Favored Pre-proline 0 N--CA 1.497 1.883 0 O-C-N 119.62 -1.925 . . . . 0.8 113.32 -176.959 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.545 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.6 Cg_exo -59.68 -40.2 66.87 Favored 'Trans proline' 0 N--CA 1.494 1.547 0 CA-C-N 121.347 1.517 . . . . 0.28 112.129 -178.79 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -68.5 -48.92 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 C-N-CA 118.77 -1.172 . . . . 0.37 109.481 179.626 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.5 t80 -61.15 -50.63 72.42 Favored 'General case' 0 C--N 1.301 -1.534 0 O-C-N 121.229 -0.919 . . . . 0.16 109.317 179.145 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 56.9 t60 -67.99 -41.7 81.88 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-O 121.156 0.503 . . . . 0.32 110.974 -179.99 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.465 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.2 m -64.72 -37.76 88.69 Favored 'General case' 0 N--CA 1.5 2.064 0 O-C-N 121.051 -1.031 . . . . 0.22 110.392 -179.7 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.2 mt -63.54 -23.67 67.49 Favored 'General case' 0 N--CA 1.491 1.604 0 O-C-N 121.444 -0.785 . . . . 0.22 110.62 -178.764 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.9 m -53.14 -39.88 63.83 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 120.724 -1.235 . . . . 0.16 108.064 -179.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 76.0 mm-40 -82.9 -17.77 42.54 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.421 -0.8 . . . . 2.16 109.292 179.369 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -75.65 -37.3 59.76 Favored 'General case' 0 N--CA 1.495 1.795 0 N-CA-C 106.95 -1.5 . . . . 1.78 106.95 179.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -122.03 68.48 0.93 Allowed 'General case' 0 N--CA 1.493 1.709 0 N-CA-C 106.977 -1.49 . . . . 0.25 106.977 178.05 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -63.59 -11.05 21.64 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.815 -0.809 . . . . 0.22 108.815 -179.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 36.1 t30 -89.97 8.77 30.72 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 108.414 -0.958 . . . . 1.13 108.414 179.174 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.41 HG13 ' HB3' ' A' ' 22' ' ' LEU . 45.6 t -127.56 146.09 33.86 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 N-CA-C 108.355 -0.98 . . . . 0.24 108.355 179.347 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.3 mm -99.96 122.31 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.991 0 O-C-N 121.033 -1.042 . . . . 0.15 109.451 -178.771 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.534 ' C ' HD12 ' A' ' 55' ' ' LEU . 46.9 m-85 -103.73 127.95 51.15 Favored 'General case' 0 N--CA 1.501 2.093 0 O-C-N 121.272 -0.892 . . . . 0.12 109.164 179.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 54' ' ' PHE . 3.8 mp -111.35 139.95 46.34 Favored 'General case' 0 N--CA 1.504 2.241 0 O-C-N 121.249 -0.907 . . . . 0.22 109.153 179.22 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 73.1 tt0 -111.87 129.89 56.01 Favored 'General case' 0 C--N 1.301 -1.525 0 N-CA-C 106.828 -1.545 . . . . 1.13 106.828 178.064 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.1 t -127.25 139.12 52.79 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 121.608 -0.682 . . . . 0.15 110.851 -177.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.8 t0 -99.22 118.38 35.78 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 108.598 -0.89 . . . . 1.05 108.598 178.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 23.8 m -68.05 -18.41 23.52 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 O-C-N 120.257 -1.527 . . . . 0.16 108.608 179.103 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.509 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.8 m-20 -92.27 -43.11 9.47 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.494 -0.754 . . . . 1.08 111.566 -179.134 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.458 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.2 m-20 -95.66 -16.66 21.88 Favored 'General case' 0 N--CA 1.506 2.343 0 O-C-N 120.719 -1.238 . . . . 1.07 108.701 179.849 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.1 37.78 4.29 Favored 'General case' 0 N--CA 1.493 1.707 0 N-CA-C 107.632 -1.247 . . . . 0.14 107.632 179.599 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.2 pt20 -59.93 -20.48 57.66 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.69 -0.631 . . . . 1.47 110.154 -178.653 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.598 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -66.97 -36.77 82.94 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 120.969 -1.082 . . . . 1.05 108.464 179.498 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.598 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.9 t -72.45 -45.65 58.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.487 0 O-C-N 121.424 -0.798 . . . . 0.35 109.742 179.655 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.87 -36.65 70.16 Favored 'General case' 0 N--CA 1.494 1.759 0 O-C-N 121.542 -0.724 . . . . 0.26 111.328 -178.961 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 93.1 p -60.47 -37.02 79.68 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 120.76 -1.212 . . . . 0.24 109.184 -179.081 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.6 -35.48 80.64 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.495 -0.753 . . . . 2.06 109.369 179.462 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.407 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -87.27 -1.29 57.8 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.383 -0.823 . . . . 0.23 110.772 -179.08 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 36.1 mp0 54.87 49.87 16.87 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.215 -0.928 . . . . 2.02 109.846 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 25.4 t -66.51 135.88 27.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.476 0 O-C-N 120.915 -1.116 . . . . 0.16 108.562 -179.472 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -107.41 -15.46 14.62 Favored 'General case' 0 N--CA 1.488 1.448 0 O-C-N 121.71 -0.619 . . . . 1.6 109.836 -179.3 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.442 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.5 154.49 22.92 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.897 -1.127 . . . . 0.14 111.333 -179.673 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.444 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.5 p -124.52 155.7 68.71 Favored Pre-proline 0 N--CA 1.497 1.882 0 N-CA-C 107.954 -1.128 . . . . 0.15 107.954 178.695 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -77.22 141.39 68.53 Favored 'Cis proline' 0 N--CA 1.495 1.567 0 C-N-CA 123.769 -1.346 . . . . 0.16 113.025 -2.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.442 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.2 m -125.87 130.73 51.92 Favored 'General case' 0 N--CA 1.499 1.992 0 N-CA-C 108.644 -0.872 . . . . 0.13 108.644 177.804 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 96.8 m-85 -108.77 131.44 54.95 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 108.759 -0.83 . . . . 0.2 108.759 -179.827 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.407 HE22 ' HB1' ' A' ' 69' ' ' ALA . 74.9 mt-30 -122.97 143.48 49.89 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 108.35 -0.982 . . . . 0.29 108.35 179.842 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 67.3 m-85 -109.71 134.11 52.37 Favored 'General case' 0 N--CA 1.491 1.594 0 CA-C-O 121.334 0.588 . . . . 0.14 110.594 -179.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.5 m-85 -126.83 148.76 49.95 Favored 'General case' 0 N--CA 1.491 1.577 0 N-CA-C 109.406 -0.59 . . . . 0.15 109.406 179.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -147.2 127.61 14.02 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.926 -1.138 . . . . 1.68 107.926 -179.929 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 95.5 mttt 53.48 33.58 16.4 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.91 -1.119 . . . . 1.22 108.296 -178.724 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.49 20.17 79.65 Favored Glycine 0 N--CA 1.494 2.552 0 N-CA-C 110.201 -1.16 . . . . 0.23 110.201 179.949 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.1 mm100 -124.07 134.06 53.48 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 121.351 -1.088 . . . . 2.07 111.088 -179.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 60.1 tttm -77.9 126.17 30.44 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 121.418 -0.801 . . . . 1.82 109.25 178.93 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.7 m -124.12 4.35 5.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.994 0 O-C-N 121.637 -0.664 . . . . 0.3 111.038 -179.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.67 160.63 25.97 Favored Glycine 0 N--CA 1.496 2.669 0 C-N-CA 118.14 -1.981 . . . . 0.17 111.581 -179.816 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.4 tm-20 -168.56 148.02 4.41 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 122.088 -0.654 . . . . 1.93 109.882 -179.842 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 26.0 p90 -162.06 160.1 27.06 Favored 'General case' 0 N--CA 1.502 2.153 0 O-C-N 121.277 -0.889 . . . . 0.14 109.118 177.492 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -126.1 160.82 29.11 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.486 0.66 . . . . 0.12 109.991 -179.421 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.471 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.36 143.28 6.44 Favored Glycine 0 N--CA 1.494 2.521 0 N-CA-C 109.014 -1.635 . . . . 0.12 109.014 179.357 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.4 65.71 3.78 Favored 'General case' 0 C--N 1.301 -1.513 0 O-C-N 121.044 -1.268 . . . . 0.18 109.877 -179.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.06 97.07 5.62 Favored 'General case' 0 N--CA 1.498 1.971 0 N-CA-C 108.622 -0.881 . . . . 0.88 108.622 178.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.44 -33.53 73.09 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.489 -0.757 . . . . 1.06 111.384 -179.634 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -63.86 -29.97 71.1 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.862 -1.149 . . . . 1.61 109.239 -179.887 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.8 ttmm -60.53 -36.93 79.6 Favored 'General case' 0 C--N 1.295 -1.769 0 CA-C-O 121.439 0.638 . . . . 1.45 109.51 -179.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 53.9 mt -57.82 -39.75 78.38 Favored 'General case' 0 C--N 1.302 -1.486 0 CA-C-O 122.084 0.945 . . . . 0.19 108.499 179.32 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 12.4 tm-20 -60.98 -43.43 98.82 Favored 'General case' 0 C--N 1.289 -2.047 0 C-N-CA 119.904 -0.718 . . . . 2.1 110.879 -178.082 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.28 -43.86 76.81 Favored 'General case' 0 C--N 1.299 -1.624 0 O-C-N 121.206 -0.934 . . . . 0.19 111.507 -178.156 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.5 m -65.3 -40.3 93.62 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 120.709 -1.244 . . . . 0.2 109.706 -178.885 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 75.6 mt -60.95 -49.58 84.09 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.708 0 N-CA-C 108.196 -1.039 . . . . 0.16 108.196 179.608 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.468 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.3 t-20 -60.29 -36.04 76.94 Favored 'General case' 0 C--N 1.301 -1.52 0 CA-C-O 121.923 0.868 . . . . 0.95 108.678 179.131 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 45.3 tt0 -67.44 -39.98 85.42 Favored 'General case' 0 C--N 1.299 -1.605 0 O-C-N 121.808 -0.558 . . . . 2.21 110.091 -178.723 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.613 ' HB2' HD11 ' A' ' 22' ' ' LEU . 87.7 mt -100.88 2.61 41.09 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 121.299 -0.875 . . . . 0.25 111.17 -179.095 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.468 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.7 p . . . . . 0 N--CA 1.498 1.942 0 O-C-N 120.423 -1.423 . . . . 1.08 109.263 -179.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_exo . . . . . 0 N--CA 1.494 1.537 0 CA-C-O 121.195 0.415 . . . . 1.46 112.272 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -97.47 119.82 36.71 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.504 -0.748 . . . . 0.88 109.084 179.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.414 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.9 m -104.76 129.95 52.92 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 121.513 -0.742 . . . . 0.7 109.023 179.989 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 37.2 mt -65.49 -30.91 71.74 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.354 -0.842 . . . . 0.61 109.095 179.959 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.414 ' H ' HG22 ' B' ' 61' ' ' THR . 69.5 mmtt -63.28 -21.24 66.12 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.26 -0.9 . . . . 1.31 110.407 -179.535 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.471 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.5 mm -129.91 139.91 50.33 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.407 0 O-C-N 121.672 -0.643 . . . . 0.15 109.424 -179.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.0 m -101.03 132.05 46.63 Favored 'General case' 0 N--CA 1.5 2.042 0 N-CA-C 106.88 -1.526 . . . . 0.19 106.88 177.973 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 49.8 m -83.93 140.01 32.22 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 120.603 -1.311 . . . . 0.2 111.219 -177.817 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.444 ' NE1' HG23 ' A' ' 74' ' ' THR . 20.6 m95 -73.15 -8.65 56.73 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.223 -0.923 . . . . 0.21 109.921 179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -55.29 -11.65 0.82 Allowed 'General case' 0 N--CA 1.49 1.564 0 O-C-N 120.949 -1.095 . . . . 0.49 108.917 -179.976 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.413 HG11 ' CH2' ' A' ' 31' ' ' TRP . 16.8 m -60.23 139.18 20.1 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.469 0 O-C-N 121.238 -0.914 . . . . 1.04 109.21 179.872 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 47.3 m-20 -59.99 -40.38 88.97 Favored 'General case' 0 N--CA 1.487 1.415 0 O-C-N 121.193 -0.942 . . . . 1.36 109.174 -179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.037 0 N-CA-C 109.016 -1.634 . . . . 2.32 109.016 -179.694 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 73.9 mmm . . . . . 0 N--CA 1.49 1.551 0 N-CA-C 109.389 -0.596 . . . . 2.88 109.389 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.424 HG21 ' ND1' ' A' ' 43' ' ' HIS . 63.1 t -99.03 136.32 30.52 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.045 0 O-C-N 121.466 -0.771 . . . . 0.45 109.104 -179.974 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.6 tptt -131.18 129.94 42.36 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.243 -0.911 . . . . 1.67 108.796 -179.781 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -98.72 124.1 43.35 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.114 -0.991 . . . . 0.31 108.884 179.323 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -102.8 115.08 44.12 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 N-CA-C 108.666 -0.864 . . . . 0.19 108.666 178.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 27.7 mm-40 -97.79 -0.05 45.95 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.16 -0.962 . . . . 2.25 110.173 179.828 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.12 154.22 34.36 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 120.869 -1.144 . . . . 0.15 111.01 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 35.5 ttmt -63.64 -32.39 73.85 Favored 'General case' 0 N--CA 1.489 1.476 0 N-CA-C 108.175 -1.046 . . . . 1.65 108.175 178.384 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 47.6 m -57.24 -48.43 78.85 Favored 'General case' 0 C--N 1.303 -1.438 0 C-N-CA 119.179 -1.008 . . . . 0.23 108.596 -179.338 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.75 -31.01 69.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.36 -0.837 . . . . 0.17 109.163 178.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.529 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.1 t80 -59.45 -44.03 93.06 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.159 -0.963 . . . . 0.14 109.006 -179.883 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -65.56 -40.88 93.33 Favored 'General case' 0 C--N 1.297 -1.684 0 N-CA-C 108.705 -0.85 . . . . 1.31 108.705 179.872 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.34 -37.12 86.12 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.555 -0.716 . . . . 1.77 110.327 179.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.76 -42.34 81.91 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 121.327 -0.858 . . . . 0.15 109.054 -179.596 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.529 HD11 ' CE2' ' A' ' 11' ' ' PHE . 55.0 mt -60.73 -40.35 92.04 Favored 'General case' 0 C--N 1.302 -1.458 0 N-CA-C 108.609 -0.885 . . . . 0.17 108.609 179.775 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 16.8 t0 -70.04 -38.5 75.85 Favored 'General case' 0 C--N 1.303 -1.427 0 O-C-N 121.632 -0.667 . . . . 1.07 110.275 179.931 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.3 -37.38 80.58 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.254 -0.904 . . . . 0.18 109.988 -178.922 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.27 -30.85 69.71 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.204 -0.935 . . . . 0.17 109.303 -179.843 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.03 -127.28 30.06 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.931 -1.268 . . . . 0.2 109.931 179.826 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -89.92 1.34 56.35 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.263 -1.139 . . . . 1.07 110.689 -179.003 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttt -73.34 150.0 42.17 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.788 -1.195 . . . . 1.5 109.493 -179.766 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.674 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.48 156.29 16.49 Favored 'General case' 0 C--N 1.308 -1.233 0 N-CA-C 107.472 -1.307 . . . . 0.47 107.472 179.861 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.674 ' H ' HD23 ' A' ' 22' ' ' LEU . 84.4 t -143.34 111.33 1.79 Allowed 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.132 -0.98 . . . . 0.17 108.992 -179.635 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 24.5 t -99.89 140.57 18.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 N-CA-C 108.135 -1.061 . . . . 0.14 108.135 179.794 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.53 123.96 67.26 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.981 0 O-C-N 121.325 -0.859 . . . . 0.13 109.249 -179.325 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.523 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 27.4 t70 -102.32 118.43 36.87 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.465 -0.772 . . . . 1.05 109.692 179.845 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 54.4 m-85 -95.42 23.15 6.18 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.197 -0.939 . . . . 0.73 109.974 179.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.1 m -59.13 145.7 41.47 Favored 'General case' 0 C--N 1.3 -1.567 0 O-C-N 120.742 -1.224 . . . . 0.3 110.078 -178.294 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.724 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.74 126.87 32.87 Favored 'General case' 0 C--N 1.304 -1.41 0 N-CA-C 107.957 -1.127 . . . . 0.22 107.957 179.424 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.0 t -68.08 -30.14 69.25 Favored 'General case' 0 C--N 1.298 -1.657 0 N-CA-C 108.263 -1.014 . . . . 0.3 108.263 179.806 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.724 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.1 p-90 -76.44 -15.03 60.01 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.488 -0.757 . . . . 0.26 110.624 -179.895 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 34.0 t -86.16 121.05 28.21 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 120.809 -1.182 . . . . 0.26 108.378 179.812 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -64.66 -53.62 33.83 Favored Glycine 0 N--CA 1.495 2.58 0 O-C-N 121.542 -0.724 . . . . 0.23 112.698 -177.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.5 Cg_endo -61.11 -29.92 88.16 Favored 'Trans proline' 0 C--N 1.312 -1.379 0 CA-C-N 119.349 1.575 . . . . 0.31 112.279 -179.418 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.34 -48.22 17.92 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.155 -0.966 . . . . 0.24 109.442 179.5 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.2 tttt -59.75 -30.84 69.13 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.067 -1.021 . . . . 1.59 109.111 179.122 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.508 ' SD ' ' O ' ' A' ' 37' ' ' MET . 13.8 tmm? -59.69 -28.4 67.27 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.643 -0.661 . . . . 2.1 109.498 -179.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 9.6 mt -81.48 -4.13 7.42 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.059 0 O-C-N 121.545 -0.722 . . . . 0.49 111.179 -179.594 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.21 -31.95 10.49 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 119.982 -1.699 . . . . 0.8 113.528 -177.063 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.9 Cg_exo -59.09 -39.84 75.99 Favored 'Trans proline' 0 N--CA 1.494 1.529 0 CA-C-N 121.387 1.531 . . . . 0.28 113.244 -178.115 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -69.12 -49.22 59.03 Favored 'General case' 0 C--N 1.302 -1.494 0 O-C-N 120.504 -1.372 . . . . 0.37 108.849 -179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -59.99 -51.22 70.57 Favored 'General case' 0 C--N 1.299 -1.607 0 N-CA-C 108.728 -0.842 . . . . 0.16 108.728 178.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.424 ' ND1' HG21 ' A' ' 2' ' ' VAL . 46.3 t60 -66.11 -44.14 85.16 Favored 'General case' 0 C--N 1.3 -1.585 0 O-C-N 121.897 -0.502 . . . . 0.32 110.985 179.399 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.444 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.5 m -63.24 -39.98 96.13 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 120.828 -1.17 . . . . 0.22 110.722 -179.322 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -61.02 -23.9 65.76 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 121.194 -0.941 . . . . 0.22 110.596 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.2 m -52.14 -40.19 61.01 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.84 -1.163 . . . . 0.16 108.602 -179.239 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.9 mm-40 -84.66 -15.33 45.75 Favored 'General case' 0 C--N 1.301 -1.502 0 O-C-N 121.316 -0.865 . . . . 2.16 109.569 179.343 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.3 tttt -76.97 -38.08 53.95 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 107.502 -1.296 . . . . 1.78 107.502 179.408 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -121.64 68.0 0.91 Allowed 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 106.671 -1.603 . . . . 0.25 106.671 178.012 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 57.8 p -63.22 -9.88 13.18 Favored 'General case' 0 C--N 1.308 -1.212 0 N-CA-C 108.384 -0.969 . . . . 0.22 108.384 -179.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.5 t30 -90.23 9.75 27.36 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 108.129 -1.063 . . . . 1.13 108.129 178.86 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.3 t -127.85 143.94 39.21 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.601 0 N-CA-C 107.861 -1.163 . . . . 0.24 107.861 179.008 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.6 mm -99.95 120.58 49.56 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 O-C-N 120.994 -1.066 . . . . 0.15 109.483 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.575 ' C ' HD12 ' A' ' 55' ' ' LEU . 51.9 m-85 -103.3 126.06 50.27 Favored 'General case' 0 N--CA 1.507 2.408 0 O-C-N 121.181 -0.949 . . . . 0.12 109.816 179.807 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.575 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -110.09 144.49 38.62 Favored 'General case' 0 N--CA 1.506 2.358 0 O-C-N 121.257 -0.902 . . . . 0.22 110.045 178.995 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -112.97 131.48 55.73 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.24 -1.393 . . . . 1.13 107.24 177.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.5 t -129.5 132.81 66.14 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.277 -0.89 . . . . 0.15 110.409 -178.283 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.469 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 51.7 t0 -94.58 120.05 34.21 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.376 -0.827 . . . . 1.05 109.308 179.796 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.6 m -66.55 -18.17 23.7 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.478 -1.389 . . . . 0.16 108.156 179.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 16.1 m-20 -93.29 -44.79 8.14 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.441 -0.787 . . . . 1.08 112.264 -179.564 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.443 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 78.9 m-20 -94.83 -13.61 25.38 Favored 'General case' 0 N--CA 1.505 2.3 0 O-C-N 120.554 -1.341 . . . . 1.07 108.91 179.897 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.469 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.4 37.88 4.31 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 107.542 -1.281 . . . . 0.14 107.542 179.086 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.1 pt20 -60.12 -20.9 60.55 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.772 -0.58 . . . . 1.47 109.496 -178.927 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.655 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -62.64 -36.96 84.51 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 120.929 -1.107 . . . . 1.05 108.473 179.633 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.655 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.4 t -73.31 -42.11 57.51 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 O-C-N 121.299 -0.876 . . . . 0.35 109.112 179.427 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.7 -41.43 79.15 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.392 -0.818 . . . . 0.26 111.083 -178.984 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.5 p -59.99 -37.94 81.13 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 120.983 -1.073 . . . . 0.24 109.666 -178.492 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -66.61 -37.93 85.92 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.269 -0.894 . . . . 2.06 109.507 179.208 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.56 -3.73 58.98 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.159 -0.963 . . . . 0.23 110.948 -178.942 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 54.05 49.88 17.87 Favored 'General case' 0 N--CA 1.499 1.977 0 O-C-N 120.984 -1.073 . . . . 2.02 110.541 179.676 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 32.2 t -64.85 131.69 30.64 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 120.723 -1.236 . . . . 0.16 108.999 -179.24 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -102.45 -10.73 19.14 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.572 -0.705 . . . . 1.6 110.655 -179.168 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.504 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.97 154.27 17.38 Favored 'General case' 0 N--CA 1.495 1.784 0 O-C-N 120.607 -1.308 . . . . 0.14 111.136 179.881 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.409 HG23 ' NE1' ' B' ' 67' ' ' TRP . 34.4 p -127.36 154.12 77.17 Favored Pre-proline 0 N--CA 1.502 2.147 0 N-CA-C 107.585 -1.265 . . . . 0.15 107.585 178.372 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.3 Cg_endo -75.97 141.64 71.25 Favored 'Cis proline' 0 N--CA 1.497 1.718 0 C-N-CA 124.172 -1.179 . . . . 0.16 113.006 -1.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 91.5 m -126.98 132.29 50.84 Favored 'General case' 0 N--CA 1.501 2.107 0 CA-C-O 121.657 0.742 . . . . 0.13 109.26 178.552 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.701 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.2 m-85 -109.0 130.24 55.47 Favored 'General case' 0 N--CA 1.493 1.698 0 N-CA-C 108.779 -0.823 . . . . 0.2 108.779 179.873 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 -122.16 140.35 52.67 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 108.615 -0.883 . . . . 0.29 108.615 179.635 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 84.5 m-85 -107.9 134.86 50.22 Favored 'General case' 0 N--CA 1.493 1.698 0 CA-C-O 121.398 0.618 . . . . 0.14 110.186 -179.28 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -129.19 146.04 51.2 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-O 121.288 0.566 . . . . 0.15 109.56 179.679 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.6 ttmt -145.46 134.89 23.13 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 107.283 -1.376 . . . . 1.68 107.283 179.037 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.8 mttt 50.06 33.36 6.81 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.923 -1.11 . . . . 1.22 109.014 -178.44 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.98 25.68 74.22 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.58 -1.408 . . . . 0.23 109.58 179.747 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.4 mm100 -129.14 132.78 47.4 Favored 'General case' 0 N--CA 1.498 1.966 0 O-C-N 121.465 -1.02 . . . . 2.07 110.989 -179.991 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -79.1 122.89 26.8 Favored 'General case' 0 N--CA 1.491 1.606 0 N-CA-C 109.083 -0.71 . . . . 1.82 109.083 179.175 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.0 m -123.35 8.33 5.21 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.83 0 O-C-N 121.584 -0.698 . . . . 0.3 110.433 -179.873 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.44 153.86 14.35 Favored Glycine 0 N--CA 1.495 2.578 0 C-N-CA 118.344 -1.884 . . . . 0.17 111.82 179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 8.0 tm-20 -166.05 149.11 7.39 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 122.033 -0.686 . . . . 1.93 109.56 179.559 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.43 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 19.9 p90 -163.66 163.66 24.22 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 119.279 -0.968 . . . . 0.14 109.339 177.405 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.91 160.34 31.3 Favored 'General case' 0 N--CA 1.498 1.944 0 CA-C-O 121.504 0.669 . . . . 0.12 110.191 -179.378 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.2 141.69 5.94 Favored Glycine 0 N--CA 1.491 2.36 0 N-CA-C 109.594 -1.402 . . . . 0.12 109.594 179.143 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -77.27 65.41 2.85 Favored 'General case' 0 C--N 1.3 -1.552 0 O-C-N 121.288 -1.125 . . . . 0.18 109.347 179.969 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.55 93.95 4.3 Favored 'General case' 0 N--CA 1.5 2.04 0 N-CA-C 108.587 -0.894 . . . . 0.88 108.587 179.048 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.03 -33.47 74.65 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.273 -0.892 . . . . 1.06 111.494 -179.199 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -63.84 -29.79 70.95 Favored 'General case' 0 N--CA 1.488 1.455 0 O-C-N 120.758 -1.214 . . . . 1.61 109.307 -179.936 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.43 ' NZ ' ' CD2' ' A' ' 89' ' ' PHE . 56.5 tttm -61.11 -34.75 75.46 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.558 -0.714 . . . . 1.45 109.215 -179.674 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.701 HD21 ' CD1' ' A' ' 77' ' ' PHE . 38.6 mt -58.92 -38.91 80.03 Favored 'General case' 0 C--N 1.305 -1.366 0 N-CA-C 107.967 -1.123 . . . . 0.19 107.967 179.363 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.7 tt0 -61.93 -42.54 99.21 Favored 'General case' 0 C--N 1.296 -1.718 0 C-N-CA 119.906 -0.718 . . . . 2.1 110.966 -178.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.75 -43.8 75.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.003 -1.061 . . . . 0.19 111.717 -178.671 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.4 m -65.65 -39.63 91.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 120.694 -1.254 . . . . 0.2 110.055 -178.753 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -60.92 -49.15 85.83 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 O-C-N 120.921 -1.112 . . . . 0.16 108.73 179.195 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.445 ' O ' HG12 ' A' ' 105' ' ' VAL . 21.6 t-20 -60.5 -35.52 76.13 Favored 'General case' 0 C--N 1.3 -1.563 0 N-CA-C 108.151 -1.055 . . . . 0.95 108.151 179.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -67.45 -39.94 85.39 Favored 'General case' 0 C--N 1.296 -1.723 0 CA-C-N 115.973 -0.558 . . . . 2.21 110.143 -178.885 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.672 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.6 mt -99.23 -1.46 39.12 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.172 -0.955 . . . . 0.25 111.344 -178.858 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.445 HG12 ' O ' ' A' ' 102' ' ' ASN . 4.9 p . . . . . 0 N--CA 1.498 1.97 0 O-C-N 120.49 -1.381 . . . . 1.08 109.426 -179.631 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 66.0 Cg_exo . . . . . 0 N--CA 1.493 1.454 0 CA-C-O 120.81 0.254 . . . . 1.46 112.687 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.48 125.78 38.27 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 120.87 -1.144 . . . . 0.88 109.279 179.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.414 ' O ' ' O ' ' B' ' 64' ' ' ILE . 51.3 m -107.11 129.86 54.77 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.467 -0.77 . . . . 0.7 108.962 179.958 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.1 mt -67.97 -31.27 70.87 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.231 -0.918 . . . . 0.61 109.795 179.663 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.411 ' H ' HG22 ' B' ' 61' ' ' THR . 41.1 mmtm -63.06 -19.97 64.89 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.508 -0.745 . . . . 1.31 109.459 -179.456 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.445 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.6 mm -129.56 140.0 50.21 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.339 0 O-C-N 121.843 -0.535 . . . . 0.15 109.732 -179.843 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -98.06 127.33 43.94 Favored 'General case' 0 N--CA 1.497 1.909 0 N-CA-C 106.525 -1.658 . . . . 0.19 106.525 177.129 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.0 m -80.79 145.2 31.58 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 120.833 -1.167 . . . . 0.2 110.755 -178.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.504 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.0 m95 -77.39 -9.94 59.16 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.133 -0.979 . . . . 0.21 108.815 179.575 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.95 -12.19 0.2 Allowed 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.355 -0.841 . . . . 0.49 108.762 179.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.457 ' N ' ' C ' ' B' ' 67' ' ' TRP . 11.9 m -61.61 139.0 21.3 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 C-N-CA 119.226 -0.99 . . . . 1.04 109.181 179.819 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 43.4 m-20 -60.25 -38.37 83.29 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.32 -0.863 . . . . 1.36 109.409 -179.629 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.2 0 N-CA-C 109.398 -1.481 . . . . 2.32 109.398 -179.678 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 86.3 mmm . . . . . 0 N--CA 1.492 1.634 0 CA-C-O 121.43 0.633 . . . . 2.88 109.664 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.3 t -98.79 133.02 42.88 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.454 -0.779 . . . . 0.45 109.956 -179.508 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.3 tptt -129.92 129.47 43.91 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.345 -0.983 . . . . 1.67 108.345 179.935 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.532 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 65.4 tt0 -96.75 124.26 40.68 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.421 -0.799 . . . . 0.31 108.944 179.632 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.8 mm -102.65 117.1 47.52 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 N-CA-C 108.505 -0.924 . . . . 0.19 108.505 179.265 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.532 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 64.4 mm-40 -99.72 -2.51 35.1 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.289 -0.882 . . . . 2.25 109.888 -179.443 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -155.15 157.27 37.17 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.185 -0.947 . . . . 0.15 111.115 -179.621 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.2 ttmm -64.95 -31.95 73.43 Favored 'General case' 0 N--CA 1.491 1.6 0 N-CA-C 108.191 -1.04 . . . . 1.65 108.191 178.638 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 94.4 m -55.84 -48.4 75.57 Favored 'General case' 0 C--N 1.304 -1.401 0 C-N-CA 119.354 -0.938 . . . . 0.23 109.191 -178.886 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.72 -30.33 67.93 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.254 -0.904 . . . . 0.17 109.218 179.083 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.5 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.3 t80 -58.88 -44.26 91.09 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.326 -0.859 . . . . 0.14 109.38 -179.248 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -64.81 -42.31 95.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 121.308 -0.87 . . . . 1.31 109.151 179.7 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.534 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.55 -39.58 94.78 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.753 -0.592 . . . . 1.77 110.451 179.266 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.99 -41.1 87.35 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.234 -0.917 . . . . 0.15 109.12 -178.947 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.5 HD11 ' CE2' ' A' ' 11' ' ' PHE . 77.8 mt -60.58 -40.42 91.67 Favored 'General case' 0 C--N 1.306 -1.296 0 N-CA-C 108.11 -1.07 . . . . 0.17 108.11 179.149 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.8 t0 -69.09 -35.99 77.09 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.353 0.597 . . . . 1.07 110.416 179.725 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.67 -37.4 79.58 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.271 -0.893 . . . . 0.18 109.541 -179.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.15 -34.6 73.78 Favored 'General case' 0 N--CA 1.491 1.582 0 O-C-N 121.363 -0.836 . . . . 0.17 109.799 179.662 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.21 -125.65 21.66 Favored Glycine 0 N--CA 1.492 2.382 0 N-CA-C 110.019 -1.232 . . . . 0.2 110.019 -179.801 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.2 m-20 -90.86 2.41 56.17 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.237 -1.155 . . . . 1.07 110.462 -179.09 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 76.0 mttt -73.83 151.83 40.42 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 120.93 -1.106 . . . . 1.5 109.622 -179.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.671 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.52 158.16 18.65 Favored 'General case' 0 C--N 1.308 -1.225 0 N-CA-C 106.811 -1.552 . . . . 0.47 106.811 179.377 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.671 ' H ' HD23 ' A' ' 22' ' ' LEU . 57.8 t -145.62 123.53 4.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.562 0 O-C-N 120.987 -1.07 . . . . 0.17 108.743 179.916 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -112.2 140.25 32.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 N-CA-C 108.483 -0.932 . . . . 0.14 108.483 179.925 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.7 t -123.44 119.99 58.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.115 0 O-C-N 121.358 -0.838 . . . . 0.13 109.499 -179.171 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 41.2 t0 -97.42 119.75 36.54 Favored 'General case' 0 N--CA 1.504 2.237 0 O-C-N 121.306 -0.871 . . . . 1.05 110.038 179.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.4 m-85 -96.52 25.26 5.21 Favored 'General case' 0 N--CA 1.507 2.407 0 O-C-N 120.955 -1.091 . . . . 0.73 110.175 179.5 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.524 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.4 m -59.89 147.33 38.91 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 120.954 -1.091 . . . . 0.3 110.773 -178.604 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.577 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.48 126.53 32.87 Favored 'General case' 0 C--N 1.304 -1.37 0 N-CA-C 107.772 -1.196 . . . . 0.22 107.772 179.045 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.5 -33.97 76.19 Favored 'General case' 0 C--N 1.297 -1.698 0 N-CA-C 108.024 -1.102 . . . . 0.3 108.024 179.918 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.577 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 59.7 p-90 -71.35 -26.63 62.9 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.447 -0.783 . . . . 0.26 110.686 179.476 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.6 t -80.7 112.9 18.51 Favored 'General case' 0 N--CA 1.49 1.571 0 N-CA-C 107.834 -1.172 . . . . 0.26 107.834 -179.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.469 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.36 -51.22 60.09 Favored Glycine 0 N--CA 1.487 2.048 0 N-CA-C 111.274 -0.73 . . . . 0.23 111.274 -178.884 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.469 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -49.84 -37.87 46.41 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.754 1.277 . . . . 0.31 111.318 -179.929 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.524 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -75.37 -46.98 29.73 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.191 -0.943 . . . . 0.24 108.913 178.953 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 58.9 tttp -59.74 -30.15 68.64 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.626 -0.879 . . . . 1.59 108.626 179.376 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 12.4 tpt -59.67 -30.19 68.58 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.601 -0.687 . . . . 2.1 110.14 179.874 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.443 HD11 ' HB1' ' A' ' 92' ' ' ALA . 6.3 mt -83.58 -4.79 8.7 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.905 0 O-C-N 121.695 -0.628 . . . . 0.49 110.756 -178.571 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.548 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.54 -31.94 10.21 Favored Pre-proline 0 N--CA 1.492 1.628 0 O-C-N 119.803 -1.81 . . . . 0.8 113.236 -176.836 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.548 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -57.91 -38.96 90.35 Favored 'Trans proline' 0 N--CA 1.489 1.253 0 CA-C-N 121.487 1.567 . . . . 0.28 111.914 -177.705 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 62.7 m-85 -71.79 -51.23 23.66 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.146 -0.971 . . . . 0.37 108.985 179.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -58.44 -48.04 82.01 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.16 -0.962 . . . . 0.16 108.613 179.747 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -68.62 -41.24 79.77 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.567 -0.708 . . . . 0.32 110.746 178.384 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.467 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 58.7 m -63.82 -37.21 86.53 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.997 -1.064 . . . . 0.22 109.952 -179.742 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 69.1 mt -62.29 -27.82 69.29 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.108 -0.995 . . . . 0.22 110.649 -178.649 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.2 m -51.73 -38.02 53.5 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 120.873 -1.142 . . . . 0.16 109.03 -179.081 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 -87.02 -15.7 37.88 Favored 'General case' 0 N--CA 1.487 1.412 0 O-C-N 121.12 -0.987 . . . . 2.16 109.458 179.804 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 37.8 ttmt -79.02 -37.94 37.82 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.625 -1.297 . . . . 1.78 107.709 179.225 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -120.32 65.93 0.83 Allowed 'General case' 0 N--CA 1.493 1.702 0 N-CA-C 106.857 -1.534 . . . . 0.25 106.857 178.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.4 p -62.93 -8.11 6.51 Favored 'General case' 0 N--CA 1.484 1.246 0 N-CA-C 108.625 -0.88 . . . . 0.22 108.625 -179.477 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 40.6 t30 -91.02 4.44 52.08 Favored 'General case' 0 N--CA 1.487 1.397 0 N-CA-C 108.957 -0.757 . . . . 1.13 108.957 179.296 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.503 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.0 t -124.29 147.84 28.67 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.689 0 N-CA-C 107.078 -1.453 . . . . 0.24 107.078 178.977 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -100.17 123.5 53.08 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.118 0 O-C-N 120.956 -1.09 . . . . 0.15 109.248 -178.42 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.579 ' C ' HD12 ' A' ' 55' ' ' LEU . 52.4 m-85 -103.94 126.87 51.38 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.35 -0.844 . . . . 0.12 110.039 179.367 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.579 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.4 mp -111.98 141.76 45.23 Favored 'General case' 0 N--CA 1.512 2.65 0 O-C-N 121.281 -0.887 . . . . 0.22 109.518 178.676 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.8 tt0 -111.82 132.27 54.79 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 107.313 -1.366 . . . . 1.13 107.313 177.889 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.6 t -127.88 135.68 62.31 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.268 -0.895 . . . . 0.15 110.486 -178.417 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.484 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 45.3 t0 -98.48 120.61 39.21 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.444 -0.785 . . . . 1.05 109.121 179.594 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -66.21 -19.6 25.92 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.775 0 O-C-N 120.643 -1.286 . . . . 0.16 108.404 179.075 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.525 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.0 m-20 -93.05 -41.65 9.85 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.521 -0.737 . . . . 1.08 111.812 -178.375 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 44.1 m-20 -95.54 -16.66 22.01 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 120.645 -1.284 . . . . 1.07 108.659 179.857 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.484 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.71 39.06 4.05 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 107.777 -1.194 . . . . 0.14 107.777 179.615 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.2 pt20 -60.11 -19.99 56.07 Favored 'General case' 0 C--N 1.302 -1.469 0 O-C-N 121.753 -0.592 . . . . 1.47 109.938 -178.742 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.581 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -65.03 -36.55 84.74 Favored 'General case' 0 C--N 1.298 -1.652 0 O-C-N 121.073 -1.017 . . . . 1.05 108.877 179.826 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.581 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -72.73 -42.44 61.94 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.313 0 N-CA-C 108.409 -0.96 . . . . 0.35 108.409 179.322 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.04 -40.66 82.81 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.608 -0.683 . . . . 0.26 110.568 -179.013 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.6 p -60.23 -40.29 89.71 Favored 'General case' 0 C--N 1.3 -1.558 0 C-N-CA 118.761 -1.175 . . . . 0.24 109.577 -178.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 13.8 tm-20 -66.2 -39.38 89.61 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.209 -0.932 . . . . 2.06 109.175 179.522 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.419 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.52 -4.68 59.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.152 -0.968 . . . . 0.23 110.739 -179.344 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 53.77 49.98 18.01 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 120.852 -1.155 . . . . 2.02 109.887 179.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 44.6 t -65.01 130.46 30.23 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.615 0 C-N-CA 118.425 -1.31 . . . . 0.16 108.375 -179.511 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 42.9 mmtm -103.05 -11.07 18.39 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.576 -0.702 . . . . 1.6 110.694 -178.806 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.495 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -161.25 155.81 23.2 Favored 'General case' 0 N--CA 1.497 1.882 0 O-C-N 120.599 -1.313 . . . . 0.14 110.605 179.726 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.1 p -129.44 153.63 80.63 Favored Pre-proline 0 N--CA 1.501 2.1 0 N-CA-C 108.148 -1.056 . . . . 0.15 108.148 178.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -76.59 143.33 75.75 Favored 'Cis proline' 0 N--CA 1.489 1.259 0 C-N-CA 123.613 -1.411 . . . . 0.16 112.667 -2.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.495 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.3 m -127.85 135.0 49.44 Favored 'General case' 0 N--CA 1.494 1.76 0 N-CA-C 108.23 -1.026 . . . . 0.13 108.23 178.464 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -113.32 131.84 55.8 Favored 'General case' 0 N--CA 1.494 1.744 0 N-CA-C 108.966 -0.753 . . . . 0.2 108.966 -179.916 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.419 HE22 ' HB1' ' A' ' 69' ' ' ALA . 69.6 mt-30 -120.44 141.86 49.76 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 108.283 -1.006 . . . . 0.29 108.283 179.116 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.6 m-85 -108.03 134.8 50.42 Favored 'General case' 0 C--N 1.299 -1.626 0 CA-C-O 121.472 0.653 . . . . 0.14 110.226 -179.23 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.6 m-85 -128.64 147.11 50.71 Favored 'General case' 0 N--CA 1.488 1.437 0 N-CA-C 109.176 -0.675 . . . . 0.15 109.176 179.594 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.5 tttt -149.62 125.29 10.39 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.788 -1.19 . . . . 1.68 107.788 179.371 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 59.74 30.2 19.78 Favored 'General case' 0 N--CA 1.497 1.911 0 N-CA-C 107.787 -1.19 . . . . 1.22 107.787 -178.162 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.1 14.91 81.8 Favored Glycine 0 N--CA 1.491 2.349 0 N-CA-C 109.713 -1.355 . . . . 0.23 109.713 179.769 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.428 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 4.4 mm-40 -116.89 135.64 53.56 Favored 'General case' 0 N--CA 1.504 2.263 0 O-C-N 121.546 -0.973 . . . . 2.07 110.91 -178.98 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.7 tttm -78.98 123.88 27.72 Favored 'General case' 0 N--CA 1.496 1.854 0 N-CA-C 108.695 -0.854 . . . . 1.82 108.695 178.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.2 m -123.8 7.61 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.955 0 O-C-N 121.472 -0.768 . . . . 0.3 111.439 -179.058 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.95 156.13 17.22 Favored Glycine 0 N--CA 1.498 2.819 0 C-N-CA 118.426 -1.845 . . . . 0.17 111.513 179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -164.71 149.17 9.34 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.872 -0.781 . . . . 1.93 109.353 178.838 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.447 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 7.0 p90 -163.86 159.44 21.09 Favored 'General case' 0 C--N 1.3 -1.559 0 C-N-CA 119.635 -0.826 . . . . 0.14 109.78 178.201 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.6 p -127.37 160.65 30.76 Favored 'General case' 0 N--CA 1.492 1.668 0 CA-C-O 121.595 0.712 . . . . 0.12 109.924 -178.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.476 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.22 140.6 5.7 Favored Glycine 0 N--CA 1.489 2.225 0 N-CA-C 109.17 -1.572 . . . . 0.12 109.17 179.431 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.443 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.28 67.27 2.5 Favored 'General case' 0 C--N 1.304 -1.382 0 O-C-N 121.219 -1.165 . . . . 0.18 109.146 179.785 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.37 95.09 4.59 Favored 'General case' 0 N--CA 1.501 2.078 0 N-CA-C 108.548 -0.908 . . . . 0.88 108.548 178.864 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.8 -34.76 77.39 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.141 -0.975 . . . . 1.06 111.403 -179.268 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -62.97 -28.71 70.27 Favored 'General case' 0 C--N 1.297 -1.687 0 O-C-N 121.077 -1.015 . . . . 1.61 109.412 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.84 -34.64 76.33 Favored 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.331 -0.856 . . . . 1.45 108.836 -179.327 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.4 mt -59.46 -38.69 81.44 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.218 -1.03 . . . . 0.19 108.218 179.421 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.1 tt0 -63.16 -43.4 98.41 Favored 'General case' 0 C--N 1.295 -1.779 0 C-N-CA 119.845 -0.742 . . . . 2.1 110.46 -178.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -44.0 77.33 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.112 -0.992 . . . . 0.19 111.143 -178.551 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.9 m -65.37 -39.67 92.6 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 120.973 -1.079 . . . . 0.2 110.706 -178.812 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.9 mt -62.01 -48.36 88.9 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.867 0 O-C-N 121.067 -1.02 . . . . 0.16 108.267 179.57 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 105' ' ' VAL . 26.0 t-20 -60.5 -34.75 74.52 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.194 -1.039 . . . . 0.95 108.194 178.492 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.9 tt0 -67.93 -39.89 83.44 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.548 -0.72 . . . . 2.21 110.63 -178.488 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.655 ' HB2' HD11 ' A' ' 22' ' ' LEU . 86.2 mt -100.68 0.28 38.76 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 121.226 -0.922 . . . . 0.25 111.273 -178.802 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.8 p . . . . . 0 N--CA 1.497 1.905 0 O-C-N 120.569 -1.332 . . . . 1.08 108.992 -179.517 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo . . . . . 0 N--CA 1.495 1.572 0 CA-C-O 121.169 0.404 . . . . 1.46 112.291 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -98.12 121.36 39.95 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.185 -0.947 . . . . 0.88 109.401 -179.831 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.439 ' O ' ' O ' ' B' ' 64' ' ' ILE . 25.2 m -107.51 131.85 53.88 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.441 -0.787 . . . . 0.7 109.543 -179.546 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 55.5 mt -64.49 -31.47 72.7 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.218 -0.926 . . . . 0.61 109.473 -179.802 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.419 ' H ' HG22 ' B' ' 61' ' ' THR . 26.8 mmtp -64.69 -16.54 63.02 Favored 'General case' 0 N--CA 1.495 1.788 0 N-CA-C 108.847 -0.797 . . . . 1.31 108.847 -179.853 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.476 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.7 mm -126.34 139.97 50.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 N-CA-C 109.372 -0.603 . . . . 0.15 109.372 179.871 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 5.0 m -96.45 127.98 42.96 Favored 'General case' 0 N--CA 1.498 1.96 0 N-CA-C 106.54 -1.652 . . . . 0.19 106.54 177.492 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . 0.43 ' O ' HG12 ' B' ' 69' ' ' VAL . 54.3 m -78.89 144.25 35.09 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.852 -1.155 . . . . 0.2 110.554 -178.204 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.442 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.8 m95 -79.62 -14.62 58.68 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.293 -0.879 . . . . 0.21 109.056 179.308 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.405 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.0 m120 -57.42 -11.66 2.05 Favored 'General case' 0 N--CA 1.487 1.419 0 N-CA-C 107.788 -1.19 . . . . 0.49 107.788 179.14 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.53 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.7 p -64.12 136.93 25.69 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 O-C-N 121.682 -0.636 . . . . 1.04 109.322 179.769 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 43.2 m-20 -60.46 -38.42 84.14 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.247 -0.908 . . . . 1.36 108.622 179.607 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . 0.53 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.337 0 CA-C-O 117.93 -1.483 . . . . 2.32 109.695 179.994 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 96.6 mmm . . . . . 0 N--CA 1.491 1.598 0 CA-C-O 121.307 0.575 . . . . 2.88 109.546 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.449 HG12 ' N ' ' A' ' 3' ' ' LYS . 61.5 t -98.96 159.53 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.958 0 O-C-N 121.467 -0.771 . . . . 0.45 109.539 -179.661 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.449 ' N ' HG12 ' A' ' 2' ' ' VAL . 21.6 tptm -129.96 130.02 44.52 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.782 -0.821 . . . . 1.67 108.782 -179.474 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.5 tt0 -97.01 124.03 40.88 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.867 -0.79 . . . . 0.31 108.867 179.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.2 mm -102.15 115.83 44.72 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 108.17 -1.048 . . . . 0.19 108.17 179.401 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 17.7 mm-40 -99.68 0.14 41.33 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.333 -0.854 . . . . 2.25 109.619 -179.632 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.2 155.15 37.21 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.146 -0.971 . . . . 0.15 110.929 -179.836 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.599 ' HA ' HG22 ' A' ' 65' ' ' VAL . 4.3 ttpm? -65.26 -32.85 74.72 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.765 -1.198 . . . . 1.65 107.765 177.916 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.444 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 46.5 m -58.71 -46.98 86.12 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 108.215 -1.031 . . . . 0.23 108.215 -179.642 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.24 -31.76 70.53 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.37 -0.831 . . . . 0.17 108.837 178.572 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.559 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.2 t80 -59.81 -43.71 94.37 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.097 -1.002 . . . . 0.14 109.15 -179.793 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.7 mm-40 -64.45 -44.01 92.47 Favored 'General case' 0 C--N 1.298 -1.644 0 C-N-CA 119.584 -0.847 . . . . 1.31 108.796 -179.773 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.44 -41.1 98.66 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.565 -0.709 . . . . 1.77 110.723 179.301 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.76 -42.17 95.34 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.252 -0.905 . . . . 0.15 109.285 -179.177 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.559 HD11 ' CE2' ' A' ' 11' ' ' PHE . 87.1 mt -59.85 -39.86 86.62 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.089 -1.007 . . . . 0.17 108.418 179.156 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 19.2 t70 -69.41 -34.67 74.81 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.592 -0.693 . . . . 1.07 110.476 -179.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.4 -38.02 80.9 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.233 -0.917 . . . . 0.18 110.591 -178.983 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.21 -30.97 69.72 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.127 -0.983 . . . . 0.17 110.067 -179.519 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.95 -125.7 25.42 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.171 -1.172 . . . . 0.2 110.171 179.956 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 77.0 m-20 -90.7 3.49 54.1 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.257 -1.143 . . . . 1.07 109.964 -179.212 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.2 mttp -75.63 148.55 38.67 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.282 -0.886 . . . . 1.5 109.892 -179.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.698 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.54 157.78 16.51 Favored 'General case' 0 N--CA 1.489 1.49 0 N-CA-C 107.667 -1.234 . . . . 0.47 107.667 179.306 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.698 ' H ' HD23 ' A' ' 22' ' ' LEU . 46.9 t -147.01 118.07 1.56 Allowed 'Isoleucine or valine' 0 N--CA 1.487 1.409 0 O-C-N 120.903 -1.123 . . . . 0.17 108.884 179.624 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.2 t -106.59 139.48 27.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.378 -0.971 . . . . 0.14 108.378 179.537 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.5 t -123.02 122.62 66.06 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.272 0 O-C-N 121.135 -0.978 . . . . 0.13 110.081 -178.683 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -98.21 119.7 37.34 Favored 'General case' 0 N--CA 1.497 1.88 0 O-C-N 121.441 -0.787 . . . . 1.05 109.919 179.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 57.4 m-85 -96.38 24.46 5.79 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.068 -1.02 . . . . 0.73 109.886 179.102 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.436 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.7 m -58.64 146.94 34.38 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.024 -1.048 . . . . 0.3 110.077 -179.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.678 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.55 122.92 30.37 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 107.926 -1.139 . . . . 0.22 107.926 179.117 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.2 t -67.28 -30.26 70.08 Favored 'General case' 0 C--N 1.297 -1.68 0 C-N-CA 118.962 -1.095 . . . . 0.3 108.088 179.737 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.678 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 52.1 p-90 -71.45 -27.0 62.96 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 121.441 -0.787 . . . . 0.26 110.885 179.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.6 t -83.79 120.49 26.1 Favored 'General case' 0 N--CA 1.489 1.488 0 N-CA-C 108.109 -1.071 . . . . 0.26 108.109 -179.694 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.452 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -62.37 -52.1 51.69 Favored Glycine 0 N--CA 1.489 2.2 0 C-N-CA 119.846 -1.169 . . . . 0.23 111.042 -178.516 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.452 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.4 Cg_exo -52.15 -34.58 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.472 0 CA-C-N 118.702 1.251 . . . . 0.31 112.59 -179.744 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.436 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.96 -53.77 7.05 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.245 -0.91 . . . . 0.24 110.276 -179.358 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 41.9 tttp -60.0 -37.37 79.48 Favored 'General case' 0 N--CA 1.493 1.711 0 O-C-N 120.803 -1.185 . . . . 1.59 109.701 179.92 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.525 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.0 tmm? -58.46 -27.98 64.89 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.148 -0.97 . . . . 2.1 109.342 -179.328 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.487 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.4 mt -87.01 -12.07 10.89 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.657 0 O-C-N 121.599 -0.688 . . . . 0.49 112.051 -179.193 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 29.6 pttt -67.44 -30.53 3.03 Favored Pre-proline 0 N--CA 1.499 1.997 0 O-C-N 120.062 -1.649 . . . . 0.8 113.511 -177.504 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.8 Cg_exo -49.79 -36.78 43.43 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 121.803 1.68 . . . . 0.28 112.215 -178.345 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 34.7 m-85 -67.79 -44.13 78.09 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 106.384 -1.71 . . . . 0.37 106.384 178.175 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 77.2 t80 -60.35 -52.45 65.21 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.187 -0.946 . . . . 0.16 110.101 178.289 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 41.2 t60 -67.62 -40.11 84.68 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.49 -0.757 . . . . 0.32 109.928 -179.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 70.3 m -61.17 -39.58 90.7 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.381 -0.824 . . . . 0.22 110.567 -179.641 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.2 mt -62.36 -19.58 63.52 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 121.45 -0.781 . . . . 0.22 110.707 -178.486 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 67.0 m -55.4 -37.12 67.18 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 120.593 -1.317 . . . . 0.16 108.471 -179.511 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -82.73 -19.8 37.22 Favored 'General case' 0 C--N 1.297 -1.675 0 O-C-N 121.509 -0.744 . . . . 2.16 109.103 179.441 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.6 tttp -76.62 -37.36 56.5 Favored 'General case' 0 N--CA 1.493 1.683 0 N-CA-C 107.91 -1.144 . . . . 1.78 107.91 -179.791 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 78.1 m-85 -123.69 67.12 1.02 Allowed 'General case' 0 N--CA 1.494 1.734 0 N-CA-C 107.136 -1.431 . . . . 0.25 107.136 177.879 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 80.2 p -63.44 -10.05 15.47 Favored 'General case' 0 C--N 1.307 -1.244 0 CA-C-O 121.42 0.629 . . . . 0.22 109.573 -179.383 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.2 t30 -91.02 10.43 26.69 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.215 -1.031 . . . . 1.13 108.215 179.073 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 22' ' ' LEU . 48.2 t -128.52 148.21 32.98 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 N-CA-C 108.353 -0.98 . . . . 0.24 108.353 179.617 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.443 HG22 ' CD1' ' A' ' 55' ' ' LEU . 30.0 mm -98.79 123.95 51.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.077 0 O-C-N 121.129 -0.982 . . . . 0.15 109.688 -178.767 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.505 ' C ' HD12 ' A' ' 55' ' ' LEU . 65.7 m-85 -108.43 123.86 49.52 Favored 'General case' 0 N--CA 1.507 2.378 0 O-C-N 121.354 -0.841 . . . . 0.12 109.246 179.754 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.505 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.9 mp -110.26 144.81 38.41 Favored 'General case' 0 N--CA 1.511 2.604 0 O-C-N 120.906 -1.121 . . . . 0.22 110.136 179.022 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -112.54 129.73 56.26 Favored 'General case' 0 N--CA 1.494 1.762 0 N-CA-C 106.577 -1.638 . . . . 1.13 106.577 177.514 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.4 t -126.46 135.54 63.45 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.192 0 O-C-N 121.19 -0.944 . . . . 0.15 110.63 -178.019 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.696 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.2 t0 -94.47 119.66 33.51 Favored 'General case' 0 N--CA 1.487 1.414 0 N-CA-C 108.738 -0.838 . . . . 1.05 108.738 179.436 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.2 m -69.16 -18.52 22.85 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.793 0 C-N-CA 118.638 -1.225 . . . . 0.16 108.453 179.068 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.564 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.8 m-20 -93.01 -42.68 9.3 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.45 -0.781 . . . . 1.08 111.343 -179.281 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.484 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 81.3 m-20 -93.92 -15.26 25.13 Favored 'General case' 0 N--CA 1.503 2.192 0 O-C-N 120.623 -1.298 . . . . 1.07 108.098 179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.696 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.4 38.39 4.16 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 107.684 -1.228 . . . . 0.14 107.684 179.177 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.8 pt20 -59.56 -22.63 61.99 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.404 -0.81 . . . . 1.47 109.8 -178.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 4.8 p-10 -66.07 -42.9 88.81 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.104 -0.997 . . . . 1.05 108.766 179.279 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.599 HG22 ' HA ' ' A' ' 8' ' ' LYS . 21.2 t -68.72 -44.01 82.6 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.661 0 O-C-N 121.328 -0.858 . . . . 0.35 109.88 179.989 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.94 -36.81 72.78 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.215 -0.928 . . . . 0.26 110.324 -179.651 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.8 p -61.6 -31.66 71.74 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.045 -1.034 . . . . 0.24 108.711 -179.678 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -63.81 -40.16 95.97 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.445 -0.785 . . . . 2.06 109.398 179.324 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.403 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -88.69 1.39 55.19 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.461 -0.774 . . . . 0.23 110.923 -179.182 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 54.49 50.83 15.23 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 120.991 -1.068 . . . . 2.02 109.246 -178.953 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.1 t -64.35 129.16 27.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.572 0 C-N-CA 118.261 -1.376 . . . . 0.16 107.939 -179.283 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.8 mmtt -101.71 -12.71 18.16 Favored 'General case' 0 N--CA 1.489 1.478 0 O-C-N 121.65 -0.656 . . . . 1.6 109.904 -178.54 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.47 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.58 156.93 21.4 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.98 -1.075 . . . . 0.14 110.7 179.91 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 31.2 p -129.38 154.62 80.71 Favored Pre-proline 0 N--CA 1.501 2.103 0 N-CA-C 108.184 -1.043 . . . . 0.15 108.184 178.859 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.0 Cg_endo -75.0 142.02 73.51 Favored 'Cis proline' 0 N--CA 1.495 1.601 0 C-N-CA 123.841 -1.316 . . . . 0.16 113.439 -1.562 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.47 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -126.31 132.19 51.68 Favored 'General case' 0 N--CA 1.5 2.05 0 N-CA-C 108.521 -0.918 . . . . 0.13 108.521 177.939 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.598 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.5 m-85 -111.39 127.15 55.57 Favored 'General case' 0 N--CA 1.491 1.612 0 N-CA-C 108.401 -0.962 . . . . 0.2 108.401 -178.935 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.403 HE22 ' CB ' ' A' ' 69' ' ' ALA . 76.6 mt-30 -119.5 141.48 49.15 Favored 'General case' 0 N--CA 1.5 2.038 0 O-C-N 121.149 -0.969 . . . . 0.29 108.898 179.801 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.405 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 70.8 m-85 -107.8 132.21 53.64 Favored 'General case' 0 N--CA 1.493 1.723 0 CA-C-O 121.198 0.523 . . . . 0.14 110.177 -179.36 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.0 m-85 -125.63 146.3 49.77 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.553 0.692 . . . . 0.15 109.499 179.376 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.9 ttmt -146.69 129.78 16.46 Favored 'General case' 0 N--CA 1.49 1.55 0 N-CA-C 107.622 -1.251 . . . . 1.68 107.622 179.814 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 90.5 mttt 53.34 31.99 12.89 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.108 -0.995 . . . . 1.22 109.76 -178.148 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.36 19.78 77.83 Favored Glycine 0 N--CA 1.491 2.321 0 O-C-N 120.954 -1.091 . . . . 0.23 110.879 179.162 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.4 mt-30 -128.77 139.79 52.03 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.311 -1.111 . . . . 2.07 110.378 -179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -81.3 127.83 33.16 Favored 'General case' 0 N--CA 1.496 1.864 0 O-C-N 121.196 -0.94 . . . . 1.82 109.506 178.898 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.2 m -123.94 9.74 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.608 -0.683 . . . . 0.3 110.283 179.804 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.97 151.14 9.68 Favored Glycine 0 N--CA 1.5 2.952 0 C-N-CA 118.719 -1.705 . . . . 0.17 111.713 -179.437 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.8 tt0 -166.06 148.92 7.3 Favored 'General case' 0 N--CA 1.495 1.807 0 O-C-N 121.621 -0.929 . . . . 1.93 109.806 179.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 31.7 p90 -163.72 162.93 24.25 Favored 'General case' 0 N--CA 1.491 1.594 0 C-N-CA 119.598 -0.841 . . . . 0.14 108.81 177.217 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.7 p -126.74 159.92 32.34 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 109.351 -0.611 . . . . 0.12 109.351 -179.613 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.487 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.4 143.37 6.16 Favored Glycine 0 N--CA 1.494 2.532 0 N-CA-C 109.834 -1.306 . . . . 0.12 109.834 178.841 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.42 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.58 65.12 2.34 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.15 -1.206 . . . . 0.18 110.098 179.996 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.484 ' ND2' ' OE1' ' A' ' 95' ' ' GLU . 0.7 OUTLIER -119.46 94.0 4.27 Favored 'General case' 0 N--CA 1.504 2.228 0 N-CA-C 107.936 -1.135 . . . . 0.88 107.936 178.334 . . . . . . . . 3 3 . 1 . 005 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.78 -33.15 73.4 Favored 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.079 -1.013 . . . . 1.06 111.303 -179.03 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.484 ' OE1' ' ND2' ' A' ' 93' ' ' ASN . 35.1 mp0 -63.41 -30.18 71.35 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.943 -1.098 . . . . 1.61 109.291 179.949 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.5 tttt -60.73 -33.68 73.27 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.167 -0.679 . . . . 1.45 109.167 -179.295 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.598 HD21 ' CD1' ' A' ' 77' ' ' PHE . 35.8 mt -59.76 -38.95 83.22 Favored 'General case' 0 C--N 1.302 -1.492 0 N-CA-C 108.566 -0.902 . . . . 0.19 108.566 179.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.6 tt0 -62.67 -40.93 98.62 Favored 'General case' 0 N--CA 1.494 1.731 0 C-N-CA 120.095 -0.642 . . . . 2.1 110.992 -178.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.39 -44.1 72.15 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.246 -0.909 . . . . 0.19 112.027 -178.053 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.55 -38.62 91.64 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.724 -1.235 . . . . 0.2 110.025 -178.365 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 55.8 mt -61.13 -48.91 86.89 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 N-CA-C 108.162 -1.051 . . . . 0.16 108.162 179.427 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.449 ' O ' HG12 ' A' ' 105' ' ' VAL . 18.1 t-20 -61.0 -34.12 74.32 Favored 'General case' 0 C--N 1.303 -1.428 0 N-CA-C 108.561 -0.903 . . . . 0.95 108.561 178.995 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 49.5 tt0 -68.85 -39.86 79.7 Favored 'General case' 0 C--N 1.302 -1.461 0 O-C-N 121.485 -0.759 . . . . 2.21 110.186 -179.26 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.566 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.4 mt -100.72 1.45 40.45 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.376 -0.828 . . . . 0.25 111.345 -178.424 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.449 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.8 p . . . . . 0 N--CA 1.499 2.002 0 O-C-N 120.475 -1.391 . . . . 1.08 109.064 179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 38.3 Cg_endo . . . . . 0 N--CA 1.493 1.466 0 CA-C-O 121.595 0.581 . . . . 1.46 110.785 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.33 119.89 27.09 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 109.012 -0.736 . . . . 0.88 109.012 -179.955 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.42 ' O ' ' O ' ' B' ' 64' ' ' ILE . 23.2 m -111.15 131.43 55.1 Favored 'General case' 0 N--CA 1.498 1.948 0 N-CA-C 109.256 -0.646 . . . . 0.7 109.256 -179.314 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 90.3 mt -67.53 -30.4 70.05 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.076 -1.015 . . . . 0.61 109.124 179.891 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.417 ' H ' HG22 ' B' ' 61' ' ' THR . 70.4 mmtt -64.55 -19.86 65.88 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.606 -0.684 . . . . 1.31 109.953 -179.445 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.487 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.1 mm -131.94 140.71 47.36 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.174 0 N-CA-C 109.716 -0.476 . . . . 0.15 109.716 -179.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 56.4 m -98.63 131.68 44.63 Favored 'General case' 0 N--CA 1.498 1.975 0 N-CA-C 106.817 -1.549 . . . . 0.19 106.817 177.022 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . 0.512 ' O ' HG12 ' B' ' 69' ' ' VAL . 68.7 m -81.18 144.85 31.33 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.629 -1.294 . . . . 0.2 111.372 -178.928 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.444 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.2 m95 -79.62 -13.86 59.21 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.391 -0.818 . . . . 0.21 109.106 178.594 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -58.5 -11.32 2.82 Favored 'General case' 0 N--CA 1.491 1.575 0 N-CA-C 107.363 -1.347 . . . . 0.49 107.363 179.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.519 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.1 p -68.27 144.13 14.6 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.4 0 N-CA-C 108.875 -0.787 . . . . 1.04 108.875 179.343 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -60.1 -39.96 87.97 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 121.176 -0.952 . . . . 1.36 109.315 -179.561 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . 0.519 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.34 0 CA-C-O 118.007 -1.441 . . . . 2.32 109.643 179.851 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.0 mmt . . . . . 0 N--CA 1.486 1.342 0 N-CA-C 108.718 -0.845 . . . . 2.88 108.718 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.475 HG12 ' N ' ' A' ' 3' ' ' LYS . 68.8 t -100.88 158.82 3.98 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.044 0 O-C-N 121.459 -0.776 . . . . 0.45 109.323 179.983 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.475 ' N ' HG12 ' A' ' 2' ' ' VAL . 21.6 tptp -129.98 126.33 37.51 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.352 -0.843 . . . . 1.67 108.77 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -93.84 121.92 35.8 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.14 -0.975 . . . . 0.31 109.316 179.681 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.3 mm -101.51 117.53 46.94 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.494 0 N-CA-C 108.492 -0.929 . . . . 0.19 108.492 178.785 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.495 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -99.1 -1.75 38.72 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.377 -0.827 . . . . 2.25 109.515 -179.377 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.26 155.33 36.38 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 120.825 -1.172 . . . . 0.15 111.542 -179.481 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.4 ttmt -63.61 -32.87 74.47 Favored 'General case' 0 N--CA 1.489 1.499 0 N-CA-C 107.94 -1.133 . . . . 1.65 107.94 177.982 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 80.5 m -58.71 -45.89 88.57 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 119.153 -1.019 . . . . 0.23 108.316 -179.964 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.86 -31.82 69.86 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.304 -0.873 . . . . 0.17 108.86 178.682 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.556 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.5 t80 -59.14 -43.94 92.04 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.088 -1.007 . . . . 0.14 108.691 179.984 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.7 mm100 -64.62 -42.67 95.34 Favored 'General case' 0 C--N 1.298 -1.635 0 N-CA-C 108.623 -0.88 . . . . 1.31 108.623 -179.944 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -64.08 -36.85 85.37 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.67 -0.644 . . . . 1.77 109.963 179.022 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.13 -42.81 79.63 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 121.071 -1.018 . . . . 0.15 109.339 -179.774 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.556 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.6 mt -60.52 -39.36 87.56 Favored 'General case' 0 C--N 1.301 -1.535 0 N-CA-C 108.124 -1.065 . . . . 0.17 108.124 179.49 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.2 t70 -69.61 -34.37 73.99 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.466 -0.771 . . . . 1.07 109.892 179.85 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.68 -37.8 70.68 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.21 -0.931 . . . . 0.18 110.3 -179.13 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.96 -32.44 73.98 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.254 -0.904 . . . . 0.17 109.309 -179.695 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.63 -124.76 21.95 Favored Glycine 0 N--CA 1.488 2.129 0 N-CA-C 109.983 -1.247 . . . . 0.2 109.983 179.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.0 m-20 -91.41 4.74 51.73 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.397 -1.061 . . . . 1.07 110.271 -179.051 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.0 mttp -76.54 149.3 36.68 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.154 -0.966 . . . . 1.5 109.096 179.641 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.644 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.86 156.68 16.76 Favored 'General case' 0 C--N 1.304 -1.376 0 N-CA-C 107.503 -1.295 . . . . 0.47 107.503 179.631 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.644 ' H ' HD23 ' A' ' 22' ' ' LEU . 97.8 t -143.09 113.15 2.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 O-C-N 120.932 -1.105 . . . . 0.17 108.676 179.783 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.1 t -100.02 139.79 20.73 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.574 0 N-CA-C 108.443 -0.947 . . . . 0.14 108.443 179.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.2 t -124.03 122.09 63.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.171 0 O-C-N 121.416 -0.803 . . . . 0.13 110.832 -178.827 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.528 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.7 t70 -98.44 120.24 38.52 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.631 -0.668 . . . . 1.05 110.305 179.451 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 59.5 m-85 -96.53 25.74 4.89 Favored 'General case' 0 N--CA 1.506 2.355 0 O-C-N 120.96 -1.088 . . . . 0.73 109.756 178.932 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.535 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 57.0 m -59.43 143.25 50.35 Favored 'General case' 0 C--N 1.3 -1.572 0 O-C-N 120.878 -1.139 . . . . 0.3 110.453 -178.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.623 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.14 127.96 33.66 Favored 'General case' 0 C--N 1.307 -1.262 0 N-CA-C 106.979 -1.489 . . . . 0.22 106.979 178.727 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -67.35 -32.25 73.06 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 118.894 -1.122 . . . . 0.3 108.318 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.623 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 61.3 p-90 -73.06 -19.8 61.1 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.023 -1.048 . . . . 0.26 110.657 179.977 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.2 t -85.24 116.73 23.76 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 120.736 -1.228 . . . . 0.26 107.867 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.451 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.57 -51.78 55.4 Favored Glycine 0 N--CA 1.496 2.662 0 O-C-N 121.659 -0.65 . . . . 0.23 111.978 -177.555 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.451 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.1 Cg_exo -52.83 -36.09 72.56 Favored 'Trans proline' 0 C--N 1.305 -1.731 0 CA-C-N 118.464 1.132 . . . . 0.31 111.907 -179.893 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.535 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -76.52 -52.57 9.52 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.516 -0.74 . . . . 0.24 110.301 -179.823 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -59.94 -36.59 77.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 121.129 -0.982 . . . . 1.59 109.332 179.966 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.506 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.9 tmm? -59.9 -29.3 68.25 Favored 'General case' 0 N--CA 1.492 1.641 0 O-C-N 121.501 -0.749 . . . . 2.1 109.549 -179.908 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.604 HG22 ' O ' ' A' ' 38' ' ' ILE . 78.5 mt -79.44 -2.26 5.08 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.744 0 O-C-N 121.913 -0.492 . . . . 0.49 110.488 -179.004 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.39 6.25 Favored Pre-proline 0 N--CA 1.497 1.899 0 O-C-N 120.591 -1.318 . . . . 0.8 114.049 -177.891 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -57.24 -39.8 87.37 Favored 'Trans proline' 0 N--CA 1.493 1.481 0 CA-C-N 121.842 1.693 . . . . 0.28 113.022 -178.1 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.0 m-85 -69.56 -48.52 60.02 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 120.262 -1.524 . . . . 0.37 108.651 179.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.7 t80 -60.06 -51.77 68.2 Favored 'General case' 0 C--N 1.3 -1.554 0 O-C-N 121.351 -0.843 . . . . 0.16 109.745 179.364 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.8 t60 -67.35 -40.94 85.87 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.589 -0.694 . . . . 0.32 110.385 179.624 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.449 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -61.31 -38.64 87.58 Favored 'General case' 0 N--CA 1.503 2.214 0 O-C-N 120.695 -1.253 . . . . 0.22 110.737 179.73 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.1 mt -63.72 -21.52 66.44 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.175 -0.953 . . . . 0.22 110.701 -178.159 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -55.67 -35.62 66.2 Favored 'General case' 0 C--N 1.296 -1.721 0 O-C-N 120.894 -1.129 . . . . 0.16 108.277 -179.615 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.494 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.0 mp0 -85.97 -19.54 30.27 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.272 -0.893 . . . . 2.16 109.897 179.598 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -76.24 -37.65 57.38 Favored 'General case' 0 N--CA 1.494 1.77 0 N-CA-C 107.468 -1.308 . . . . 1.78 107.468 179.609 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.15 67.58 0.99 Allowed 'General case' 0 N--CA 1.496 1.845 0 N-CA-C 107.078 -1.453 . . . . 0.25 107.078 178.017 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.79 -8.27 10.19 Favored 'General case' 0 C--N 1.305 -1.361 0 N-CA-C 109.037 -0.727 . . . . 0.22 109.037 -179.732 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.9 t30 -90.67 10.2 26.73 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.115 -1.068 . . . . 1.13 108.115 178.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.5 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.5 t -129.56 142.08 44.83 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.644 0 N-CA-C 107.696 -1.224 . . . . 0.24 107.696 179.037 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.457 HG22 ' CD1' ' A' ' 55' ' ' LEU . 26.8 mm -97.92 121.87 48.92 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.092 -1.005 . . . . 0.15 109.588 -178.641 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.451 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.5 m-85 -101.62 124.15 46.8 Favored 'General case' 0 N--CA 1.503 2.197 0 O-C-N 121.364 -0.835 . . . . 0.12 109.159 179.756 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.462 ' CD1' ' N ' ' A' ' 55' ' ' LEU . 2.3 mp -109.81 146.17 35.49 Favored 'General case' 0 N--CA 1.505 2.306 0 O-C-N 120.759 -1.213 . . . . 0.22 109.382 179.871 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.6 tt0 -112.8 129.21 56.51 Favored 'General case' 0 N--CA 1.496 1.847 0 N-CA-C 106.98 -1.489 . . . . 1.13 106.98 178.103 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 93.0 t -124.91 132.32 71.46 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.936 0 CA-C-O 121.503 0.668 . . . . 0.15 110.377 -178.61 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.428 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 54.6 t0 -95.68 118.7 32.84 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 108.531 -0.914 . . . . 1.05 108.531 179.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -65.59 -18.76 24.47 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.703 0 O-C-N 120.121 -1.612 . . . . 0.16 107.862 179.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.504 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.45 -40.85 10.12 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.691 -0.631 . . . . 1.08 112.23 -178.826 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.428 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 46.1 m-20 -95.61 -20.89 18.6 Favored 'General case' 0 N--CA 1.512 2.64 0 O-C-N 120.249 -1.532 . . . . 1.07 108.632 179.367 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.69 41.02 3.38 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 107.732 -1.21 . . . . 0.14 107.732 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 14.9 pt20 -60.03 -20.66 59.05 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.579 -0.701 . . . . 1.47 110.097 -178.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.721 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -62.77 -38.03 89.0 Favored 'General case' 0 N--CA 1.487 1.402 0 O-C-N 120.874 -1.141 . . . . 1.05 109.445 -179.9 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.721 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.3 t -75.18 -44.46 43.28 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.55 0 O-C-N 121.013 -1.054 . . . . 0.35 109.825 -179.789 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.34 -39.1 78.35 Favored 'General case' 0 C--N 1.299 -1.59 0 C-N-CA 119.552 -0.859 . . . . 0.26 110.206 -178.268 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.4 p -60.79 -36.48 79.12 Favored 'General case' 0 N--CA 1.488 1.458 0 O-C-N 121.007 -1.058 . . . . 0.24 108.539 -179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -63.09 -39.02 93.48 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.327 -0.858 . . . . 2.06 109.408 179.151 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.39 -0.06 55.12 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.231 -0.918 . . . . 0.23 110.697 -178.874 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 30.9 mp0 53.09 50.2 18.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.966 -1.084 . . . . 2.02 109.728 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.2 t -66.55 132.38 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.668 0 O-C-N 120.859 -1.151 . . . . 0.16 109.35 -179.03 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 83.3 mttt -103.19 -8.37 20.47 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 121.578 -0.701 . . . . 1.6 110.767 -178.986 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.497 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.62 156.16 17.95 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.573 -1.33 . . . . 0.14 111.191 -179.511 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.43 153.76 80.64 Favored Pre-proline 0 N--CA 1.502 2.148 0 N-CA-C 107.274 -1.38 . . . . 0.15 107.274 177.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 27.0 Cg_endo -75.81 143.74 77.85 Favored 'Cis proline' 0 N--CA 1.493 1.49 0 C-N-CA 123.848 -1.313 . . . . 0.16 112.788 -2.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.45 ' CG2' ' OE2' ' A' ' 88' ' ' GLU . 98.3 m -129.13 134.31 48.0 Favored 'General case' 0 N--CA 1.5 2.064 0 CA-C-O 121.808 0.813 . . . . 0.13 108.953 178.44 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.77 ' CD1' HD21 ' A' ' 97' ' ' LEU . 93.4 m-85 -110.44 129.43 55.77 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 109.329 -0.619 . . . . 0.2 109.329 -179.316 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -122.53 141.24 51.88 Favored 'General case' 0 N--CA 1.498 1.963 0 N-CA-C 108.451 -0.944 . . . . 0.29 108.451 179.123 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 75.0 m-85 -108.27 132.07 54.06 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.673 -0.642 . . . . 0.14 110.399 -179.298 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.5 m-85 -125.41 145.67 49.95 Favored 'General case' 0 N--CA 1.493 1.677 0 N-CA-C 109.337 -0.616 . . . . 0.15 109.337 178.958 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 69.3 tttt -145.92 127.47 15.1 Favored 'General case' 0 N--CA 1.494 1.729 0 N-CA-C 107.305 -1.368 . . . . 1.68 107.305 179.506 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 57.9 mttp 58.35 23.19 10.23 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.121 -1.066 . . . . 1.22 108.121 -178.105 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 82.02 15.88 73.74 Favored Glycine 0 N--CA 1.487 2.099 0 N-CA-C 110.105 -1.198 . . . . 0.23 110.105 -179.837 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.429 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.5 mm-40 -116.2 138.01 51.64 Favored 'General case' 0 N--CA 1.502 2.164 0 O-C-N 121.519 -0.989 . . . . 2.07 109.891 -179.664 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.9 ttpt -81.28 121.5 26.25 Favored 'General case' 0 N--CA 1.495 1.79 0 N-CA-C 108.012 -1.107 . . . . 1.82 108.012 178.748 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.2 m -121.28 13.3 6.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.572 -0.705 . . . . 0.3 110.254 -178.919 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -180.0 156.93 19.2 Favored Glycine 0 N--CA 1.496 2.637 0 C-N-CA 118.897 -1.621 . . . . 0.17 111.071 179.538 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.471 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 2.2 tp10 -166.84 147.73 5.91 Favored 'General case' 0 N--CA 1.487 1.407 0 O-C-N 121.65 -0.912 . . . . 1.93 108.727 179.626 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.456 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 11.0 p90 -166.98 162.58 15.69 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 119.199 -1.0 . . . . 0.14 108.945 177.199 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -128.88 169.61 14.4 Favored 'General case' 0 N--CA 1.492 1.674 0 CA-C-O 121.621 0.724 . . . . 0.12 109.821 -179.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.474 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 113.39 141.96 8.12 Favored Glycine 0 N--CA 1.491 2.323 0 N-CA-C 109.198 -1.561 . . . . 0.12 109.198 179.394 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.547 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -80.01 66.46 5.5 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.35 -1.088 . . . . 0.18 109.779 179.926 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.413 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -119.05 100.06 7.11 Favored 'General case' 0 N--CA 1.499 2.006 0 N-CA-C 107.853 -1.166 . . . . 0.88 107.853 178.382 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.44 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.99 -33.37 73.57 Favored 'General case' 0 C--N 1.297 -1.685 0 O-C-N 121.352 -0.842 . . . . 1.06 111.924 -178.751 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -64.6 -29.49 70.5 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.802 -1.186 . . . . 1.61 110.051 -179.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.413 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 55.2 tttp -61.9 -34.87 76.84 Favored 'General case' 0 C--N 1.297 -1.676 0 N-CA-C 108.699 -0.852 . . . . 1.45 108.699 -179.437 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.77 HD21 ' CD1' ' A' ' 77' ' ' PHE . 43.4 mt -59.48 -40.02 85.63 Favored 'General case' 0 N--CA 1.488 1.461 0 CA-C-O 122.279 1.038 . . . . 0.19 108.484 179.882 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.9 tt0 -62.61 -42.51 99.62 Favored 'General case' 0 C--N 1.291 -1.967 0 CA-C-N 115.545 -0.752 . . . . 2.1 110.981 -178.273 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.75 77.26 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.101 -0.999 . . . . 0.19 111.288 -178.752 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.8 m -64.76 -39.59 93.87 Favored 'General case' 0 N--CA 1.489 1.511 0 O-C-N 120.773 -1.205 . . . . 0.2 110.129 -178.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.408 ' O ' ' N ' ' A' ' 105' ' ' VAL . 65.4 mt -61.55 -49.41 84.53 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.811 0 O-C-N 121.164 -0.96 . . . . 0.16 108.509 179.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.472 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.6 t-20 -60.26 -35.55 75.77 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 122.046 0.927 . . . . 0.95 108.613 178.896 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 58.4 tt0 -67.32 -40.13 85.92 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.66 -0.65 . . . . 2.21 109.654 -178.607 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.599 ' HB2' HD11 ' A' ' 22' ' ' LEU . 95.2 mt -98.74 -3.94 34.61 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.545 -0.722 . . . . 0.25 111.458 -178.594 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.472 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.0 p . . . . . 0 N--CA 1.497 1.897 0 O-C-N 120.392 -1.443 . . . . 1.08 108.807 -179.597 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 88.4 Cg_exo . . . . . 0 N--CA 1.493 1.496 0 CA-C-O 121.393 0.497 . . . . 1.46 112.35 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -92.17 125.15 36.72 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.253 -0.905 . . . . 0.88 109.366 179.451 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.463 HG22 ' H ' ' B' ' 63' ' ' LYS . 22.3 m -103.04 130.03 50.03 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.431 -0.793 . . . . 0.7 109.502 -179.696 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.4 mt -66.76 -27.45 67.61 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.417 -0.802 . . . . 0.61 109.703 -179.568 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.463 ' H ' HG22 ' B' ' 61' ' ' THR . 29.8 mmtp -61.52 -18.28 58.45 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 121.243 -0.911 . . . . 1.31 109.711 -179.606 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.474 HD11 ' HA2' ' A' ' 91' ' ' GLY . 30.4 mm -128.8 140.42 49.29 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.363 0 O-C-N 121.914 -0.491 . . . . 0.15 110.304 -179.635 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -95.66 129.76 42.76 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 107.224 -1.399 . . . . 0.19 107.224 177.291 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.6 m -78.52 140.58 38.54 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 120.757 -1.214 . . . . 0.2 111.049 -178.886 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.497 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.0 m95 -76.12 -8.44 57.01 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.699 -1.25 . . . . 0.21 108.975 179.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -53.79 -11.95 0.47 Allowed 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.124 -0.985 . . . . 0.49 108.739 -179.926 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.442 ' N ' ' C ' ' B' ' 67' ' ' TRP . 16.8 m -61.85 143.57 14.99 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.533 0 O-C-N 121.293 -0.879 . . . . 1.04 109.602 -179.883 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 71.1 m-20 -61.27 -38.18 85.81 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.238 -0.914 . . . . 1.36 108.932 -179.683 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.228 0 N-CA-C 109.387 -1.485 . . . . 2.32 109.387 -179.879 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.5 mmm . . . . . 0 N--CA 1.492 1.651 0 CA-C-O 121.34 0.591 . . . . 2.88 109.758 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.3 t -99.47 132.17 45.43 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.056 0 O-C-N 121.508 -0.745 . . . . 0.45 109.234 179.882 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 48.2 tptt -132.29 133.54 44.19 Favored 'General case' 0 N--CA 1.499 1.989 0 O-C-N 121.208 -0.933 . . . . 1.67 108.848 179.969 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.0 tt0 -97.79 124.11 42.02 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.383 -0.823 . . . . 0.31 109.288 179.731 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.28 115.85 43.77 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 O-C-N 121.349 -0.845 . . . . 0.19 108.788 178.982 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 59.8 mm-40 -99.67 -0.89 39.27 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.265 -0.897 . . . . 2.25 108.978 179.224 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -151.68 153.88 35.25 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.046 . . . . 0.15 111.04 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.0 ttpp -64.3 -31.55 72.8 Favored 'General case' 0 N--CA 1.487 1.409 0 N-CA-C 108.254 -1.017 . . . . 1.65 108.254 178.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.5 m -58.15 -47.21 84.07 Favored 'General case' 0 C--N 1.305 -1.329 0 C-N-CA 119.382 -0.927 . . . . 0.23 108.601 -179.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.12 -30.9 70.15 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.515 -0.74 . . . . 0.17 109.107 178.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.49 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.8 t80 -59.35 -44.05 92.72 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.252 -0.905 . . . . 0.14 108.977 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.0 mm-40 -65.41 -41.85 93.17 Favored 'General case' 0 C--N 1.297 -1.68 0 N-CA-C 108.404 -0.961 . . . . 1.31 108.404 179.828 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.37 -37.49 87.7 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.664 -0.648 . . . . 1.77 110.299 179.608 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.48 -42.12 79.14 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.277 -0.89 . . . . 0.15 109.586 -179.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.49 HD11 ' CE2' ' A' ' 11' ' ' PHE . 88.3 mt -60.15 -40.63 90.52 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.166 -0.959 . . . . 0.17 108.537 -179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.9 t0 -68.48 -37.08 79.82 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.654 -0.653 . . . . 1.07 110.243 179.692 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.06 -36.65 80.21 Favored 'General case' 0 N--CA 1.489 1.475 0 O-C-N 121.44 -0.787 . . . . 0.18 110.406 -178.346 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.31 -33.11 74.8 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.041 -1.037 . . . . 0.17 109.294 179.83 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.19 20.18 Favored Glycine 0 N--CA 1.49 2.263 0 N-CA-C 110.268 -1.133 . . . . 0.2 110.268 179.628 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.462 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 71.0 m-20 -89.92 0.53 57.02 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.263 -1.139 . . . . 1.07 110.457 -179.04 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 72.4 mttt -73.98 147.59 42.87 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.825 -1.172 . . . . 1.5 109.401 -179.616 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.692 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.21 159.73 7.25 Favored 'General case' 0 N--CA 1.484 1.25 0 N-CA-C 107.118 -1.438 . . . . 0.47 107.118 179.79 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.685 ' H ' HD23 ' A' ' 22' ' ' LEU . 96.0 t -146.41 121.27 2.75 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.377 0 O-C-N 120.812 -1.18 . . . . 0.17 108.605 179.498 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.4 HG22 ' CE2' ' A' ' 79' ' ' PHE . 23.6 t -109.59 140.0 30.28 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.665 0 N-CA-C 108.305 -0.998 . . . . 0.14 108.305 179.641 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -123.59 121.27 62.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.329 -0.857 . . . . 0.13 109.557 -179.335 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.556 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 38.2 t70 -98.41 117.61 33.21 Favored 'General case' 0 N--CA 1.498 1.95 0 O-C-N 121.457 -0.777 . . . . 1.05 109.756 179.576 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 60.0 m-85 -94.48 25.72 3.78 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.142 -0.974 . . . . 0.73 110.02 179.487 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.414 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 53.2 m -59.31 146.62 38.92 Favored 'General case' 0 C--N 1.296 -1.725 0 O-C-N 121.102 -0.999 . . . . 0.3 110.616 -178.497 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.531 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.42 126.82 32.64 Favored 'General case' 0 C--N 1.304 -1.384 0 N-CA-C 107.785 -1.191 . . . . 0.22 107.785 179.103 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.13 -31.61 71.31 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 118.938 -1.105 . . . . 0.3 108.909 -179.789 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.531 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 56.1 p-90 -74.1 -22.4 59.5 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.427 -0.795 . . . . 0.26 111.04 -179.837 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 11.8 t -83.39 110.44 18.15 Favored 'General case' 0 C--N 1.303 -1.445 0 N-CA-C 107.74 -1.207 . . . . 0.26 107.74 -179.503 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.474 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.86 -50.35 68.49 Favored Glycine 0 N--CA 1.485 1.907 0 C-N-CA 120.258 -0.972 . . . . 0.23 110.772 -178.319 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.474 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.5 Cg_exo -52.48 -34.86 63.79 Favored 'Trans proline' 0 C--N 1.31 -1.494 0 CA-C-N 118.88 1.34 . . . . 0.31 111.804 179.813 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.01 -50.73 11.55 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.321 -0.862 . . . . 0.24 110.247 -179.794 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.7 tttp -60.19 -35.27 75.02 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.05 -1.031 . . . . 1.59 109.37 179.611 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.3 ttt -58.68 -27.32 64.71 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.391 -0.818 . . . . 2.1 109.571 -179.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.571 HG22 ' O ' ' A' ' 38' ' ' ILE . 70.0 mt -85.02 -3.77 8.42 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 O-C-N 121.694 -0.629 . . . . 0.49 110.882 -179.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.547 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.5 ptmt -66.94 -27.05 1.6 Allowed Pre-proline 0 N--CA 1.495 1.805 0 O-C-N 120.278 -1.514 . . . . 0.8 113.315 -177.929 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.547 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.9 Cg_exo -56.38 -39.33 91.98 Favored 'Trans proline' 0 N--CA 1.491 1.367 0 CA-C-N 122.349 1.875 . . . . 0.28 112.117 -177.592 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 45.5 m-85 -68.17 -46.06 71.77 Favored 'General case' 0 C--N 1.301 -1.506 0 C-N-CA 118.181 -1.408 . . . . 0.37 108.458 179.43 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.3 t80 -60.11 -52.1 66.79 Favored 'General case' 0 N--CA 1.49 1.542 0 CA-C-O 121.914 0.864 . . . . 0.16 109.406 179.096 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 55.4 t60 -67.27 -45.57 76.24 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 121.7 -0.625 . . . . 0.32 110.244 179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.458 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.3 m -60.2 -38.4 83.2 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.263 -0.898 . . . . 0.22 110.601 -179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 27.6 mt -63.08 -24.48 67.93 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.086 -1.009 . . . . 0.22 110.753 -179.001 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.4 m -53.4 -36.24 61.24 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 120.872 -1.142 . . . . 0.16 108.745 -178.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.5 mp0 -85.3 -15.98 41.57 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.035 -1.041 . . . . 2.16 108.627 179.3 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -79.0 -37.61 38.77 Favored 'General case' 0 N--CA 1.488 1.451 0 N-CA-C 107.393 -1.336 . . . . 1.78 107.393 179.009 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.7 m-85 -123.69 69.05 1.03 Allowed 'General case' 0 N--CA 1.494 1.751 0 N-CA-C 107.338 -1.356 . . . . 0.25 107.338 177.754 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.5 p -65.66 -13.45 59.21 Favored 'General case' 0 C--N 1.306 -1.291 0 N-CA-C 108.35 -0.981 . . . . 0.22 108.35 179.983 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 37.6 t30 -82.23 -3.74 55.69 Favored 'General case' 0 C--N 1.305 -1.364 0 N-CA-C 108.321 -0.992 . . . . 1.13 108.321 178.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.476 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.0 t -118.43 141.75 36.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.315 0 N-CA-C 107.463 -1.31 . . . . 0.24 107.463 178.752 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.3 mm -97.96 122.38 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.172 -0.955 . . . . 0.15 109.822 -178.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.657 ' C ' HD12 ' A' ' 55' ' ' LEU . 39.1 m-85 -101.06 131.51 46.94 Favored 'General case' 0 N--CA 1.505 2.29 0 O-C-N 121.311 -0.868 . . . . 0.12 110.419 -179.719 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.657 HD12 ' C ' ' A' ' 54' ' ' PHE . 6.4 mp -116.33 140.96 48.78 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.288 -0.883 . . . . 0.22 109.243 178.49 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -110.21 130.01 55.62 Favored 'General case' 0 N--CA 1.493 1.693 0 N-CA-C 106.843 -1.54 . . . . 1.13 106.843 178.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.4 t -127.99 135.11 63.73 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.023 0 O-C-N 121.253 -0.904 . . . . 0.15 110.663 -177.838 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.507 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 54.3 t0 -97.03 119.76 36.12 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.76 -0.83 . . . . 1.05 108.76 179.828 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 28.1 m -68.85 -17.63 22.22 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.786 -1.197 . . . . 0.16 108.213 178.767 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.529 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.5 m-20 -94.24 -41.02 9.69 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.403 -0.81 . . . . 1.08 112.041 -179.235 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.451 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 41.0 m-20 -96.86 -16.56 20.69 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 120.598 -1.314 . . . . 1.07 108.293 179.526 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.507 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.09 39.89 3.86 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 108.03 -1.1 . . . . 0.14 108.03 179.564 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.1 pt20 -60.08 -24.56 64.7 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 121.676 -0.64 . . . . 1.47 110.224 -178.738 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.545 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.4 p30 -63.71 -37.33 86.94 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 120.812 -1.18 . . . . 1.05 108.739 179.848 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.545 HG23 ' OD1' ' A' ' 64' ' ' ASP . 8.1 t -70.34 -44.04 77.85 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.376 0 O-C-N 121.271 -0.893 . . . . 0.35 109.587 179.679 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.77 -37.52 67.61 Favored 'General case' 0 N--CA 1.493 1.681 0 O-C-N 121.516 -0.74 . . . . 0.26 111.178 -178.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -60.26 -35.72 76.15 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.948 -1.095 . . . . 0.24 109.541 -179.207 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.6 tm-20 -63.65 -36.9 85.34 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.292 -0.88 . . . . 2.06 109.181 179.187 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.417 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -88.44 -2.21 58.47 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.23 -0.919 . . . . 0.23 110.884 -178.901 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 78.9 mm-40 55.44 49.04 17.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.04 -1.038 . . . . 2.02 109.847 -179.919 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.4 t -64.05 133.02 29.98 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 C-N-CA 118.574 -1.25 . . . . 0.16 108.442 -179.448 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.9 mmtt -104.86 -12.36 16.29 Favored 'General case' 0 N--CA 1.486 1.344 0 O-C-N 121.639 -0.663 . . . . 1.6 109.936 -178.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.452 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.55 155.99 20.34 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 120.849 -1.157 . . . . 0.14 111.207 179.976 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.405 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.5 p -129.31 155.51 79.89 Favored Pre-proline 0 N--CA 1.501 2.096 0 N-CA-C 107.859 -1.163 . . . . 0.15 107.859 178.645 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.1 Cg_endo -76.05 141.77 71.56 Favored 'Cis proline' 0 N--CA 1.493 1.469 0 C-N-CA 123.749 -1.355 . . . . 0.16 112.675 -1.957 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -127.38 137.3 52.72 Favored 'General case' 0 N--CA 1.496 1.853 0 N-CA-C 108.597 -0.89 . . . . 0.13 108.597 178.167 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.789 ' CD1' HD21 ' A' ' 97' ' ' LEU . 90.9 m-85 -113.74 130.04 56.49 Favored 'General case' 0 C--N 1.298 -1.641 0 N-CA-C 108.612 -0.884 . . . . 0.2 108.612 -179.75 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.454 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 80.9 mt-30 -120.57 140.02 52.11 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.269 -0.894 . . . . 0.29 108.673 179.341 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.436 ' CE1' HG21 ' A' ' 100' ' ' THR . 86.5 m-85 -107.48 133.01 52.6 Favored 'General case' 0 N--CA 1.494 1.733 0 CA-C-O 121.436 0.636 . . . . 0.14 110.318 -179.168 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -128.61 145.92 51.0 Favored 'General case' 0 N--CA 1.486 1.375 0 N-CA-C 108.996 -0.742 . . . . 0.15 108.996 179.513 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 52.1 tttm -147.81 131.24 16.66 Favored 'General case' 0 C--N 1.304 -1.393 0 N-CA-C 107.16 -1.422 . . . . 1.68 107.16 179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.462 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 68.6 mttm 56.01 27.93 12.0 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.279 -0.888 . . . . 1.22 109.549 -179.793 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.86 15.29 79.5 Favored Glycine 0 N--CA 1.493 2.485 0 C-N-CA 120.061 -1.066 . . . . 0.23 110.902 179.359 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -125.06 141.54 52.06 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.088 -1.243 . . . . 2.07 110.508 -179.72 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.454 ' NZ ' ' OE1' ' A' ' 78' ' ' GLN . 20.3 ttmm -78.56 126.98 31.5 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 121.274 -0.892 . . . . 1.82 109.392 179.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.1 m -123.89 11.75 5.01 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.825 0 O-C-N 121.728 -0.608 . . . . 0.3 110.173 -179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.93 154.14 14.52 Favored Glycine 0 N--CA 1.494 2.552 0 C-N-CA 118.388 -1.863 . . . . 0.17 111.743 -179.624 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.543 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 3.2 tp10 -165.14 136.49 4.07 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.997 -0.708 . . . . 1.93 109.642 179.709 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.543 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.9 p90 -163.26 158.5 21.59 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.328 -0.857 . . . . 0.14 109.947 177.911 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -127.97 160.18 32.7 Favored 'General case' 0 N--CA 1.498 1.949 0 CA-C-O 121.61 0.719 . . . . 0.12 110.37 -178.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.445 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 126.56 141.88 5.55 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.394 -1.482 . . . . 0.12 109.394 179.131 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.451 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.2 65.17 2.12 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.339 -1.095 . . . . 0.18 109.626 -179.773 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.0 97.78 5.77 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 121.353 -0.842 . . . . 0.88 108.77 179.042 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.06 -33.28 73.31 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 121.017 -1.052 . . . . 1.06 111.174 -179.508 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -65.18 -30.08 70.95 Favored 'General case' 0 N--CA 1.489 1.497 0 O-C-N 120.953 -1.092 . . . . 1.61 109.68 -179.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.54 -34.72 74.55 Favored 'General case' 0 C--N 1.298 -1.666 0 O-C-N 121.566 -0.709 . . . . 1.45 109.337 -179.289 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.789 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.4 mt -59.44 -40.07 85.59 Favored 'General case' 0 C--N 1.302 -1.49 0 N-CA-C 108.551 -0.907 . . . . 0.19 108.551 179.711 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -62.95 -43.92 97.48 Favored 'General case' 0 C--N 1.296 -1.739 0 C-N-CA 119.402 -0.919 . . . . 2.1 110.347 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.62 -44.81 77.1 Favored 'General case' 0 C--N 1.3 -1.568 0 C-N-CA 119.136 -1.026 . . . . 0.19 110.624 -178.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.436 HG21 ' CE1' ' A' ' 79' ' ' PHE . 22.0 m -64.3 -40.06 95.18 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 120.793 -1.192 . . . . 0.2 108.478 -179.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.3 mt -64.95 -46.64 91.07 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.864 0 N-CA-C 107.503 -1.295 . . . . 0.16 107.503 178.098 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.473 ' O ' HG12 ' A' ' 105' ' ' VAL . 0.9 OUTLIER -60.12 -35.94 76.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 108.05 -1.093 . . . . 0.95 108.05 179.216 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.0 tm-20 -68.73 -40.1 80.05 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.626 -0.671 . . . . 2.21 110.164 -179.579 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.692 ' HB2' HD11 ' A' ' 22' ' ' LEU . 87.6 mt -98.26 -2.73 38.9 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 121.143 -0.973 . . . . 0.25 111.63 -178.522 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.473 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.2 p . . . . . 0 N--CA 1.499 1.999 0 O-C-N 120.504 -1.372 . . . . 1.08 109.551 -179.246 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.7 Cg_endo . . . . . 0 N--CA 1.494 1.55 0 CA-C-O 121.001 0.334 . . . . 1.46 112.13 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -103.93 122.72 45.77 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.263 -0.898 . . . . 0.88 108.833 179.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.426 HG22 ' H ' ' B' ' 63' ' ' LYS . 30.7 m -108.92 129.95 55.43 Favored 'General case' 0 N--CA 1.5 2.073 0 O-C-N 121.477 -0.764 . . . . 0.7 110.002 -179.282 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 35.4 mt -66.61 -30.73 71.07 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.373 -0.83 . . . . 0.61 109.614 179.849 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.426 ' H ' HG22 ' B' ' 61' ' ' THR . 70.2 mmtt -59.15 -21.65 59.69 Favored 'General case' 0 C--N 1.301 -1.508 0 O-C-N 121.469 -0.769 . . . . 1.31 109.706 -179.101 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.445 HD11 ' HA2' ' A' ' 91' ' ' GLY . 36.3 mm -130.04 141.44 46.37 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.436 0 O-C-N 121.812 -0.555 . . . . 0.15 109.754 -179.554 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 24.2 m -99.9 131.51 45.83 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 106.934 -1.506 . . . . 0.19 106.934 177.395 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 51.6 m -84.06 142.69 30.24 Favored 'General case' 0 N--CA 1.5 2.049 0 O-C-N 120.661 -1.275 . . . . 0.2 111.441 -178.174 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.448 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.4 m95 -75.44 -11.14 59.98 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.216 -0.927 . . . . 0.21 108.995 178.745 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.43 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.0 m120 -51.86 -13.05 0.24 Allowed 'General case' 0 N--CA 1.49 1.526 0 N-CA-C 108.513 -0.921 . . . . 0.49 108.513 179.825 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.481 HG11 ' CH2' ' A' ' 31' ' ' TRP . 16.0 m -60.74 140.58 18.38 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.477 0 O-C-N 121.352 -0.842 . . . . 1.04 109.362 179.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 58.4 m-20 -60.24 -38.97 85.1 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.068 -1.02 . . . . 1.36 109.297 -179.98 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 118.202 -1.332 . . . . 2.32 110.027 -179.079 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.2 ttm . . . . . 0 N--CA 1.49 1.564 0 N-CA-C 109.238 -0.653 . . . . 2.88 109.238 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.462 HG21 ' CE1' ' A' ' 43' ' ' HIS . 94.3 t -98.24 152.73 4.16 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.161 0 O-C-N 121.177 -0.952 . . . . 0.45 109.958 -179.444 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 4.7 tppp? -130.14 126.0 36.43 Favored 'General case' 0 N--CA 1.49 1.562 0 N-CA-C 108.707 -0.849 . . . . 1.67 108.707 -179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -98.18 124.07 42.56 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 108.633 -0.877 . . . . 0.31 108.633 179.471 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.0 mm -101.16 112.66 34.84 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.441 0 N-CA-C 108.956 -0.757 . . . . 0.19 108.956 179.908 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.468 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.0 mp0 -95.53 -0.2 52.36 Favored 'General case' 0 N--CA 1.486 1.361 0 O-C-N 121.195 -0.94 . . . . 2.25 109.464 179.974 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -156.04 159.33 39.04 Favored 'General case' 0 N--CA 1.498 1.962 0 O-C-N 120.909 -1.119 . . . . 0.15 111.166 179.311 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.4 ttpt -65.41 -31.92 73.27 Favored 'General case' 0 N--CA 1.488 1.438 0 N-CA-C 108.174 -1.047 . . . . 1.65 108.174 177.952 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.8 m -58.01 -49.46 76.76 Favored 'General case' 0 C--N 1.303 -1.447 0 C-N-CA 119.517 -0.873 . . . . 0.23 109.067 -178.989 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.27 -30.26 69.24 Favored 'General case' 0 C--N 1.298 -1.656 0 O-C-N 121.323 -0.86 . . . . 0.17 109.042 178.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.54 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.7 t80 -58.48 -43.58 89.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.037 -1.039 . . . . 0.14 108.713 179.868 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 95.9 mm-40 -64.56 -43.87 92.54 Favored 'General case' 0 C--N 1.296 -1.731 0 N-CA-C 108.966 -0.753 . . . . 1.31 108.966 179.942 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.59 -36.26 83.66 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.645 -0.66 . . . . 1.77 110.059 179.489 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -42.32 80.89 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.165 -0.959 . . . . 0.15 109.19 -179.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.54 HD11 ' CE2' ' A' ' 11' ' ' PHE . 75.7 mt -61.14 -41.18 96.27 Favored 'General case' 0 C--N 1.304 -1.37 0 O-C-N 121.186 -0.946 . . . . 0.17 109.016 -179.933 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 15.3 t0 -68.46 -35.26 77.32 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.628 -0.67 . . . . 1.07 110.508 179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -39.58 81.18 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.271 -0.893 . . . . 0.18 110.234 -178.452 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.4 ' CB ' ' CG2' ' A' ' 23' ' ' VAL . . . -60.85 -34.6 74.85 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.386 -0.821 . . . . 0.17 109.746 179.567 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -124.58 21.2 Favored Glycine 0 N--CA 1.487 2.1 0 N-CA-C 109.648 -1.381 . . . . 0.2 109.648 -179.702 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 66.8 m-20 -90.75 -1.53 57.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 120.982 -1.304 . . . . 1.07 110.51 -178.935 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 50.0 mtpt -75.02 149.99 39.08 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 120.934 -1.104 . . . . 1.5 108.805 -179.815 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD23 ' HA ' ' A' ' 22' ' ' LEU . 10.8 mt -58.79 160.03 6.19 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.09 -1.006 . . . . 0.47 110.543 -179.652 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.4 ' CG2' ' CB ' ' A' ' 18' ' ' ALA . 62.9 t -148.0 111.75 0.74 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 N-CA-C 107.974 -1.121 . . . . 0.17 107.974 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.409 HG22 ' CD2' ' A' ' 79' ' ' PHE . 59.8 t -103.66 144.19 14.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.921 0 N-CA-C 107.47 -1.308 . . . . 0.14 107.47 179.709 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.9 t -125.34 122.1 62.03 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.089 0 O-C-N 121.192 -0.942 . . . . 0.13 110.549 -178.029 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 48.2 t0 -99.53 117.41 33.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.377 -0.827 . . . . 1.05 109.932 179.527 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -94.12 26.45 3.27 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.2 -0.937 . . . . 0.73 110.179 179.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -60.3 144.65 50.01 Favored 'General case' 0 N--CA 1.49 1.535 0 O-C-N 120.823 -1.173 . . . . 0.3 110.16 -178.744 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.553 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.57 125.5 32.49 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.43 -0.952 . . . . 0.22 108.43 179.296 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.0 t -65.59 -32.71 74.44 Favored 'General case' 0 C--N 1.305 -1.359 0 O-C-N 121.105 -0.997 . . . . 0.3 108.729 -179.571 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.553 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 54.7 p-90 -72.11 -23.22 61.29 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 121.196 -0.94 . . . . 0.26 111.03 179.385 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.414 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 21.5 t -81.05 123.19 28.17 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 120.768 -1.207 . . . . 0.26 108.734 -179.413 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.439 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.94 -56.53 22.0 Favored Glycine 0 N--CA 1.493 2.446 0 O-C-N 121.637 -0.664 . . . . 0.23 112.159 -178.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.439 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 8.0 Cg_endo -59.94 -29.48 89.5 Favored 'Trans proline' 0 C--N 1.314 -1.267 0 CA-C-N 119.45 1.625 . . . . 0.31 112.605 -179.687 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.414 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -77.22 -54.99 5.81 Favored 'General case' 0 N--CA 1.492 1.644 0 O-C-N 120.844 -1.16 . . . . 0.24 109.918 -179.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.3 ttpt -60.26 -39.32 86.36 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.085 -1.009 . . . . 1.59 109.444 179.722 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.512 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.3 tmt? -59.76 -28.92 67.8 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.653 -0.654 . . . . 2.1 109.89 -178.832 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.603 HG22 ' O ' ' A' ' 38' ' ' ILE . 68.0 mt -80.73 -3.7 6.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.708 -0.62 . . . . 0.49 110.454 -179.972 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.4 ptmt -65.12 -27.6 2.3 Favored Pre-proline 0 N--CA 1.49 1.53 0 O-C-N 120.486 -1.384 . . . . 0.8 113.295 -177.598 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.0 Cg_exo -55.93 -39.27 92.19 Favored 'Trans proline' 0 N--CA 1.495 1.586 0 CA-C-N 122.563 1.951 . . . . 0.28 112.888 -176.227 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 43.7 m-85 -69.12 -45.01 71.24 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.632 -1.292 . . . . 0.37 108.842 179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.5 t80 -61.38 -52.81 63.08 Favored 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.121 -0.987 . . . . 0.16 109.454 178.996 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.462 ' CE1' HG21 ' A' ' 2' ' ' VAL . 48.0 t60 -68.22 -40.29 82.12 Favored 'General case' 0 C--N 1.303 -1.443 0 O-C-N 121.774 -0.578 . . . . 0.32 110.678 179.899 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.46 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 67.8 m -62.61 -39.62 94.34 Favored 'General case' 0 N--CA 1.502 2.161 0 O-C-N 121.046 -1.034 . . . . 0.22 111.374 -179.599 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -63.92 -19.43 65.1 Favored 'General case' 0 N--CA 1.499 1.98 0 O-C-N 120.912 -1.117 . . . . 0.22 110.372 -178.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.4 m -55.16 -38.43 68.29 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 120.755 -1.216 . . . . 0.16 108.481 -178.868 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -83.2 -17.59 42.24 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.031 -1.043 . . . . 2.16 109.635 179.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.2 ttmt -77.93 -35.9 49.96 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.453 -1.314 . . . . 1.78 107.453 179.508 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 75.2 m-85 -122.46 68.15 0.95 Allowed 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.077 -1.453 . . . . 0.25 107.077 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.8 p -66.1 -9.61 32.78 Favored 'General case' 0 C--N 1.301 -1.543 0 N-CA-C 108.642 -0.873 . . . . 0.22 108.642 -179.726 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.7 t30 -88.91 6.66 38.29 Favored 'General case' 0 N--CA 1.489 1.52 0 N-CA-C 108.056 -1.09 . . . . 1.13 108.056 178.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 78.7 t -127.05 146.41 33.0 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.819 0 N-CA-C 107.885 -1.154 . . . . 0.24 107.885 179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.409 HG22 ' CD1' ' A' ' 55' ' ' LEU . 22.8 mm -99.98 123.84 53.05 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.068 0 O-C-N 120.822 -1.174 . . . . 0.15 109.777 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.487 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.2 m-85 -105.72 125.59 51.16 Favored 'General case' 0 N--CA 1.505 2.315 0 O-C-N 121.273 -0.892 . . . . 0.12 109.179 179.12 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.487 HD12 ' C ' ' A' ' 54' ' ' PHE . 3.2 mp -110.33 141.18 43.71 Favored 'General case' 0 N--CA 1.508 2.472 0 O-C-N 120.984 -1.073 . . . . 0.22 109.566 179.04 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -110.89 131.67 54.85 Favored 'General case' 0 N--CA 1.493 1.695 0 N-CA-C 106.517 -1.66 . . . . 1.13 106.517 177.835 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.3 t -126.49 137.52 57.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.018 0 O-C-N 121.404 -0.81 . . . . 0.15 110.097 -178.536 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.55 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.1 t0 -99.06 119.22 37.46 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 107.821 -1.178 . . . . 1.05 107.821 179.103 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -67.99 -18.72 23.94 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.631 0 O-C-N 120.66 -1.275 . . . . 0.16 108.469 179.814 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.551 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -92.63 -41.19 10.33 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 121.548 -0.72 . . . . 1.08 111.819 -178.86 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 20.8 m-20 -96.48 -18.71 19.66 Favored 'General case' 0 N--CA 1.501 2.105 0 O-C-N 120.596 -1.315 . . . . 1.07 108.062 179.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.55 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -120.44 38.87 3.88 Favored 'General case' 0 N--CA 1.492 1.666 0 N-CA-C 107.569 -1.271 . . . . 0.14 107.569 179.357 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 19.4 pt20 -60.34 -23.51 64.31 Favored 'General case' 0 C--N 1.302 -1.487 0 O-C-N 121.702 -0.624 . . . . 1.47 109.947 -178.541 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.605 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -64.82 -38.13 89.93 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 120.696 -1.253 . . . . 1.05 109.216 179.529 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.605 HG23 ' OD1' ' A' ' 64' ' ' ASP . 14.2 t -70.89 -44.16 76.2 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.391 0 CA-C-O 121.786 0.803 . . . . 0.35 109.618 -179.87 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.99 -39.71 72.3 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.685 -0.634 . . . . 0.26 110.5 -178.45 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.4 p -59.97 -32.54 70.93 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.936 -1.102 . . . . 0.24 109.02 -179.889 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 79.6 tt0 -62.26 -39.04 91.59 Favored 'General case' 0 N--CA 1.487 1.404 0 O-C-N 121.438 -0.789 . . . . 2.06 108.901 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.22 0.2 57.31 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.559 -0.713 . . . . 0.23 110.923 -178.984 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 28.2 mp0 53.29 49.97 18.63 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.996 -1.065 . . . . 2.02 109.684 -179.922 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.5 t -64.18 133.13 30.0 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.735 -1.228 . . . . 0.16 108.684 -179.408 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.2 -10.89 18.42 Favored 'General case' 0 N--CA 1.489 1.476 0 O-C-N 121.588 -0.695 . . . . 1.6 110.41 -179.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.469 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.18 157.08 20.04 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.595 -1.316 . . . . 0.14 111.007 179.386 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -128.53 155.08 79.38 Favored Pre-proline 0 N--CA 1.501 2.115 0 N-CA-C 107.516 -1.29 . . . . 0.15 107.516 178.752 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -75.62 140.83 68.74 Favored 'Cis proline' 0 N--CA 1.493 1.461 0 C-N-CA 123.731 -1.362 . . . . 0.16 113.206 -3.488 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.468 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -126.03 137.32 53.64 Favored 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.057 -1.09 . . . . 0.13 108.057 177.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.434 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 90.2 m-85 -115.9 131.1 57.04 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.863 -1.162 . . . . 0.2 107.863 -179.991 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 79.3 mt-30 -123.93 144.65 49.65 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.281 -0.887 . . . . 0.29 108.916 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.409 ' CD2' HG22 ' A' ' 24' ' ' VAL . 55.6 m-85 -108.23 132.51 53.58 Favored 'General case' 0 N--CA 1.491 1.59 0 CA-C-O 121.639 0.733 . . . . 0.14 110.693 -178.973 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.2 m-85 -126.86 143.37 51.29 Favored 'General case' 0 N--CA 1.486 1.372 0 N-CA-C 108.662 -0.866 . . . . 0.15 108.662 178.579 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.6 tttt -146.72 128.37 15.18 Favored 'General case' 0 C--N 1.302 -1.483 0 N-CA-C 107.536 -1.283 . . . . 1.68 107.536 179.754 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 47.2 mttp 59.22 28.22 17.47 Favored 'General case' 0 N--CA 1.493 1.678 0 N-CA-C 108.467 -0.938 . . . . 1.22 108.467 -178.79 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.11 18.96 79.06 Favored Glycine 0 N--CA 1.489 2.187 0 N-CA-C 109.742 -1.343 . . . . 0.23 109.742 -179.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -123.71 139.9 53.52 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.389 -1.065 . . . . 2.07 110.957 -179.621 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -80.03 123.32 27.73 Favored 'General case' 0 N--CA 1.497 1.876 0 N-CA-C 108.846 -0.798 . . . . 1.82 108.846 178.853 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.4 m -123.15 9.37 5.3 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.082 0 O-C-N 121.513 -0.742 . . . . 0.3 111.122 -179.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.0 160.26 27.24 Favored Glycine 0 N--CA 1.498 2.768 0 C-N-CA 118.795 -1.669 . . . . 0.17 110.948 179.769 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.499 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.5 tp10 -169.01 148.0 4.0 Favored 'General case' 0 N--CA 1.495 1.789 0 O-C-N 121.627 -0.925 . . . . 1.93 109.612 -179.782 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.499 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 5.6 p90 -168.63 157.39 8.56 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.471 -0.768 . . . . 0.14 109.911 177.948 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -128.47 160.09 33.38 Favored 'General case' 0 N--CA 1.499 2.021 0 O-C-N 121.611 -0.681 . . . . 0.12 109.5 -179.713 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.511 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.39 143.49 6.33 Favored Glycine 0 N--CA 1.495 2.62 0 N-CA-C 109.312 -1.515 . . . . 0.12 109.312 179.602 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.452 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.12 67.64 3.13 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.05 -1.265 . . . . 0.18 110.207 -179.581 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.82 95.31 4.66 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 121.478 -0.764 . . . . 0.88 108.985 178.854 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.47 -32.21 70.97 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 121.143 -0.973 . . . . 1.06 111.679 -179.513 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.3 mm-40 -64.89 -29.7 70.66 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 120.851 -1.155 . . . . 1.61 109.572 -179.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 50.7 tttp -60.34 -35.45 75.68 Favored 'General case' 0 C--N 1.299 -1.627 0 CA-C-O 121.46 0.647 . . . . 1.45 109.327 -179.261 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 57.0 mt -59.26 -39.85 84.16 Favored 'General case' 0 C--N 1.297 -1.702 0 CA-C-O 122.083 0.945 . . . . 0.19 108.709 179.324 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.2 tp10 -62.35 -43.68 98.25 Favored 'General case' 0 C--N 1.288 -2.093 0 C-N-CA 120.104 -0.638 . . . . 2.1 110.98 -177.743 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.29 -43.15 74.42 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.073 -1.017 . . . . 0.19 111.135 -178.54 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.0 m -64.96 -39.91 94.19 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.825 -1.172 . . . . 0.2 110.147 -178.443 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 68.3 mt -61.28 -49.25 85.34 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.807 0 O-C-N 121.2 -0.938 . . . . 0.16 108.496 -179.981 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.406 ' O ' HG12 ' A' ' 105' ' ' VAL . 25.9 t-20 -60.56 -34.87 74.79 Favored 'General case' 0 N--CA 1.49 1.561 0 CA-C-O 122.124 0.964 . . . . 0.95 108.653 178.898 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.8 tm-20 -67.86 -40.02 83.67 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.427 -0.796 . . . . 2.21 110.037 -178.46 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 81.6 mt -100.2 -4.61 29.17 Favored 'General case' 0 N--CA 1.501 2.076 0 O-C-N 121.216 -0.928 . . . . 0.25 111.732 -178.968 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.424 ' OXT' HG13 ' A' ' 105' ' ' VAL . 9.9 p . . . . . 0 N--CA 1.495 1.801 0 O-C-N 120.198 -1.564 . . . . 1.08 109.048 -179.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 85.8 Cg_exo . . . . . 0 N--CA 1.495 1.575 0 CA-C-O 121.113 0.38 . . . . 1.46 112.508 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.03 125.81 39.94 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.288 -0.882 . . . . 0.88 109.157 179.882 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.458 ' O ' ' O ' ' B' ' 64' ' ' ILE . 26.7 m -109.39 129.94 55.52 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.782 -0.821 . . . . 0.7 108.782 179.738 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 80.9 mt -67.97 -30.38 69.64 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 120.926 -1.109 . . . . 0.61 108.901 179.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.434 ' H ' HG22 ' B' ' 61' ' ' THR . 69.3 mmtt -59.88 -21.15 60.63 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 108.847 -0.797 . . . . 1.31 108.847 -179.897 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.511 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.5 mm -131.6 144.8 36.38 Favored 'Isoleucine or valine' 0 N--CA 1.512 2.628 0 O-C-N 121.894 -0.504 . . . . 0.15 109.822 -179.888 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.4 m -103.88 132.08 50.48 Favored 'General case' 0 N--CA 1.507 2.387 0 N-CA-C 107.522 -1.288 . . . . 0.19 107.522 177.926 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -82.56 140.74 33.1 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 120.807 -1.183 . . . . 0.2 111.054 -178.405 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.469 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 20.7 m95 -76.97 -7.94 56.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 120.896 -1.128 . . . . 0.21 108.458 179.173 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.9 m120 -54.54 -11.79 0.61 Allowed 'General case' 0 C--N 1.304 -1.38 0 N-CA-C 108.374 -0.972 . . . . 0.49 108.374 -179.759 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.476 HG11 ' CH2' ' A' ' 31' ' ' TRP . 18.9 m -60.5 140.12 18.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.446 0 O-C-N 121.379 -0.826 . . . . 1.04 108.869 179.839 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 57.1 m-20 -60.14 -40.4 89.68 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.41 -0.806 . . . . 1.36 110.149 -179.297 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.44 -1.464 . . . . 2.32 109.44 -179.317 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mmm . . . . . 0 N--CA 1.494 1.727 0 CA-C-O 121.4 0.619 . . . . 2.88 109.783 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.6 t -99.12 155.26 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.019 0 O-C-N 121.437 -0.789 . . . . 0.45 109.599 -179.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 47.8 tptt -130.09 130.01 44.31 Favored 'General case' 0 N--CA 1.497 1.875 0 N-CA-C 108.464 -0.939 . . . . 1.67 108.464 179.946 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.2 tt0 -98.89 122.25 41.89 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.295 -0.878 . . . . 0.31 108.878 179.538 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.7 mm -100.06 114.65 39.2 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.614 0 N-CA-C 108.673 -0.862 . . . . 0.19 108.673 179.386 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 32.0 mm-40 -99.77 -0.08 40.63 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.258 -0.902 . . . . 2.25 109.547 -179.949 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -154.29 156.83 37.7 Favored 'General case' 0 N--CA 1.5 2.039 0 O-C-N 120.966 -1.084 . . . . 0.15 110.982 -179.467 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -64.24 -32.21 73.71 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.974 -1.121 . . . . 1.65 107.974 178.175 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -56.49 -47.49 79.14 Favored 'General case' 0 C--N 1.303 -1.444 0 N-CA-C 108.539 -0.912 . . . . 0.23 108.539 -179.473 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.71 -31.6 69.7 Favored 'General case' 0 C--N 1.299 -1.629 0 O-C-N 121.439 -0.788 . . . . 0.17 109.243 178.8 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.505 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.9 t80 -58.7 -44.66 90.41 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.005 -1.059 . . . . 0.14 109.033 -179.717 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.1 mm-40 -64.52 -42.2 95.93 Favored 'General case' 0 C--N 1.297 -1.683 0 N-CA-C 108.832 -0.803 . . . . 1.31 108.832 179.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.7 mm-40 -64.58 -36.26 83.66 Favored 'General case' 0 N--CA 1.489 1.506 0 CA-C-O 121.383 0.611 . . . . 1.77 110.399 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.82 77.76 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.301 -0.874 . . . . 0.15 108.999 -179.698 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.505 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.5 mt -60.12 -40.05 88.39 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 107.96 -1.126 . . . . 0.17 107.96 179.751 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 31.1 t0 -69.81 -40.14 76.1 Favored 'General case' 0 C--N 1.304 -1.378 0 O-C-N 121.55 -0.719 . . . . 1.07 110.264 179.68 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -71.14 -32.37 68.87 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.37 -0.831 . . . . 0.18 110.457 -178.885 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.59 -26.19 68.57 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.048 -1.033 . . . . 0.17 108.997 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.17 -130.91 30.04 Favored Glycine 0 N--CA 1.487 2.04 0 N-CA-C 109.8 -1.32 . . . . 0.2 109.8 179.819 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.62 3.0 56.07 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.233 -1.157 . . . . 1.07 110.729 -179.205 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.6 mttt -73.44 149.49 42.38 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 120.886 -1.134 . . . . 1.5 109.665 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.645 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -58.52 158.72 7.25 Favored 'General case' 0 N--CA 1.485 1.285 0 N-CA-C 107.056 -1.461 . . . . 0.47 107.056 179.719 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.645 ' H ' HD23 ' A' ' 22' ' ' LEU . 85.3 t -143.91 109.69 1.37 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.432 0 O-C-N 120.93 -1.106 . . . . 0.17 108.816 179.878 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 28.2 t -98.64 141.27 16.65 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.493 0 N-CA-C 108.222 -1.029 . . . . 0.14 108.222 179.647 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 23.9 t -124.17 122.41 64.21 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.503 -0.748 . . . . 0.13 109.518 -178.843 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 50.4 t0 -99.3 116.45 31.5 Favored 'General case' 0 N--CA 1.501 2.081 0 O-C-N 121.275 -0.891 . . . . 1.05 109.633 179.398 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 50.9 m-85 -92.41 20.43 6.18 Favored 'General case' 0 N--CA 1.504 2.251 0 O-C-N 121.061 -1.024 . . . . 0.73 109.875 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.29 146.09 20.13 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.735 -1.228 . . . . 0.3 110.483 -178.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.729 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.6 122.4 30.48 Favored 'General case' 0 C--N 1.303 -1.427 0 N-CA-C 107.927 -1.138 . . . . 0.22 107.927 179.144 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -63.81 -29.86 71.02 Favored 'General case' 0 C--N 1.303 -1.416 0 C-N-CA 119.062 -1.055 . . . . 0.3 108.582 -179.807 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.729 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 63.6 p-90 -74.88 -17.88 60.51 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.312 -0.867 . . . . 0.26 110.694 -179.755 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -84.76 119.53 25.39 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 120.792 -1.193 . . . . 0.26 108.55 -179.986 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.481 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.97 -54.14 39.33 Favored Glycine 0 N--CA 1.492 2.384 0 C-N-CA 120.894 -0.67 . . . . 0.23 112.247 -178.236 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.481 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 6.9 Cg_endo -60.18 -29.95 90.21 Favored 'Trans proline' 0 C--N 1.312 -1.383 0 CA-C-N 119.286 1.543 . . . . 0.31 112.426 -179.481 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.49 -48.01 20.96 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.019 -1.051 . . . . 0.24 109.753 179.7 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.8 tttp -59.97 -32.48 70.86 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.18 -0.95 . . . . 1.59 109.09 179.515 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 15.1 tmm? -59.09 -26.95 65.09 Favored 'General case' 0 C--N 1.297 -1.705 0 O-C-N 121.34 -0.85 . . . . 2.1 110.041 -179.799 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.443 HD11 ' HB1' ' A' ' 92' ' ' ALA . 6.0 mt -82.21 -5.72 9.19 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.398 -0.814 . . . . 0.49 111.223 -179.837 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.563 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.02 -30.36 7.18 Favored Pre-proline 0 N--CA 1.497 1.911 0 O-C-N 119.802 -1.811 . . . . 0.8 113.336 -178.203 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.563 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.3 Cg_exo -60.0 -42.46 44.1 Favored 'Trans proline' 0 C--O 1.204 -1.189 0 CA-C-N 121.518 1.578 . . . . 0.28 112.027 -178.749 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.2 m-85 -69.22 -48.81 60.93 Favored 'General case' 0 N--CA 1.487 1.383 0 C-N-CA 118.525 -1.27 . . . . 0.37 109.362 -179.896 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.16 -52.82 63.7 Favored 'General case' 0 C--N 1.3 -1.559 0 CA-C-O 121.806 0.812 . . . . 0.16 109.775 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.3 t60 -67.87 -40.32 83.61 Favored 'General case' 0 C--N 1.297 -1.696 0 O-C-N 121.797 -0.564 . . . . 0.32 111.033 -179.385 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.473 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.6 m -64.2 -38.2 90.19 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.77 -1.206 . . . . 0.22 110.777 -179.847 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 37.7 mt -63.14 -20.5 65.44 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.141 -0.974 . . . . 0.22 111.142 -178.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -52.95 -40.53 63.74 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 120.824 -1.173 . . . . 0.16 109.075 -179.069 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.7 mm-40 -84.92 -16.64 40.39 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.115 -0.991 . . . . 2.16 109.432 179.449 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -76.21 -37.95 57.1 Favored 'General case' 0 N--CA 1.49 1.558 0 N-CA-C 107.24 -1.393 . . . . 1.78 107.24 179.994 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.43 ' C ' ' H ' ' A' ' 51' ' ' ASN . 84.3 m-85 -123.63 68.61 1.02 Allowed 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 107.282 -1.377 . . . . 0.25 107.282 177.765 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.3 p -62.81 -5.12 2.52 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 108.104 -1.073 . . . . 0.22 108.104 179.96 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.43 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.9 t-20 -80.48 -20.2 44.23 Favored 'General case' 0 N--CA 1.488 1.446 0 N-CA-C 108.921 -0.77 . . . . 1.13 108.921 178.677 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 22' ' ' LEU . 62.4 t -109.55 147.61 13.86 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.45 0 N-CA-C 108.465 -0.939 . . . . 0.24 108.465 -179.611 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -99.77 118.36 46.29 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.682 0 N-CA-C 108.695 -0.854 . . . . 0.15 108.695 -179.268 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.562 ' C ' HD12 ' A' ' 55' ' ' LEU . 21.1 m-85 -97.43 124.99 41.81 Favored 'General case' 0 N--CA 1.502 2.159 0 O-C-N 121.021 -1.05 . . . . 0.12 109.798 179.726 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.562 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.5 mp -110.07 141.75 42.47 Favored 'General case' 0 N--CA 1.506 2.336 0 O-C-N 121.264 -0.898 . . . . 0.22 108.969 179.04 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -109.79 130.17 55.55 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 106.881 -1.526 . . . . 1.13 106.881 178.105 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.7 t -125.76 135.48 63.8 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.147 0 O-C-N 121.384 -0.822 . . . . 0.15 110.414 -178.337 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.483 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.4 t0 -97.38 118.87 34.83 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.474 -0.766 . . . . 1.05 109.145 179.25 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.9 m -66.12 -20.46 27.3 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.462 0 O-C-N 120.584 -1.322 . . . . 0.16 108.392 179.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.521 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 19.0 m-20 -91.41 -44.05 9.37 Favored 'General case' 0 N--CA 1.496 1.856 0 O-C-N 121.551 -0.718 . . . . 1.08 112.077 -179.18 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.434 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 70.4 m-20 -95.21 -14.46 24.05 Favored 'General case' 0 N--CA 1.505 2.301 0 O-C-N 120.582 -1.324 . . . . 1.07 108.892 -179.868 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.483 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.92 37.82 4.32 Favored 'General case' 0 N--CA 1.493 1.7 0 N-CA-C 107.349 -1.352 . . . . 0.14 107.349 179.201 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.8 pt20 -59.93 -21.17 60.79 Favored 'General case' 0 N--CA 1.49 1.553 0 CA-C-O 121.128 0.49 . . . . 1.47 110.116 -178.557 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.593 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -65.5 -39.15 91.54 Favored 'General case' 0 C--N 1.3 -1.555 0 O-C-N 120.906 -1.121 . . . . 1.05 108.482 179.816 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.593 HG23 ' OD1' ' A' ' 64' ' ' ASP . 15.4 t -70.95 -45.67 71.76 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.454 0 O-C-N 121.434 -0.791 . . . . 0.35 109.527 179.59 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -37.42 75.84 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.545 -0.722 . . . . 0.26 110.884 -178.658 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 80.2 p -60.56 -38.0 83.11 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.978 -1.077 . . . . 0.24 109.845 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.6 tp10 -64.1 -38.89 92.69 Favored 'General case' 0 N--CA 1.491 1.608 0 O-C-N 121.192 -0.942 . . . . 2.06 109.88 179.546 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -83.46 -2.97 57.11 Favored 'General case' 0 N--CA 1.489 1.507 0 O-C-N 121.274 -0.891 . . . . 0.23 109.909 -179.169 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 55.08 49.84 16.63 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.357 -0.84 . . . . 2.02 109.479 -179.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -63.39 130.16 27.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.43 0 C-N-CA 118.708 -1.197 . . . . 0.16 108.568 -179.147 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 56.2 mttm -102.28 -10.98 19.06 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.701 -0.624 . . . . 1.6 110.57 -178.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.482 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.87 155.77 16.93 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 120.687 -1.258 . . . . 0.14 110.962 179.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -129.67 155.32 80.52 Favored Pre-proline 0 N--CA 1.504 2.238 0 N-CA-C 108.563 -0.902 . . . . 0.15 108.563 179.04 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -75.38 142.16 73.5 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.882 -1.299 . . . . 0.16 113.073 -2.394 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.482 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 87.2 m -127.3 136.23 51.65 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 108.553 -0.906 . . . . 0.13 108.553 178.198 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.626 ' CD1' HD21 ' A' ' 97' ' ' LEU . 92.7 m-85 -114.09 130.14 56.59 Favored 'General case' 0 N--CA 1.494 1.725 0 N-CA-C 108.674 -0.861 . . . . 0.2 108.674 -179.841 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.3 mt-30 -121.97 140.85 51.95 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.704 -0.85 . . . . 0.29 108.704 179.777 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.1 m-85 -107.75 132.16 53.68 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.544 0.688 . . . . 0.14 110.887 -178.488 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.0 m-85 -127.21 149.37 50.02 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.472 0.653 . . . . 0.15 109.476 179.404 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.9 tttt -149.55 125.13 10.35 Favored 'General case' 0 N--CA 1.488 1.441 0 N-CA-C 107.623 -1.251 . . . . 1.68 107.623 179.235 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.2 mttt 58.82 28.41 17.39 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 107.811 -1.181 . . . . 1.22 107.811 -178.728 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.421 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 77.55 13.51 83.43 Favored Glycine 0 N--CA 1.487 2.073 0 N-CA-C 110.049 -1.22 . . . . 0.23 110.049 -179.62 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.421 HE21 ' C ' ' A' ' 83' ' ' GLY . 6.7 mm-40 -114.78 134.69 54.91 Favored 'General case' 0 N--CA 1.506 2.371 0 O-C-N 121.269 -1.136 . . . . 2.07 110.409 -179.569 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -81.32 121.91 26.79 Favored 'General case' 0 N--CA 1.495 1.812 0 N-CA-C 108.55 -0.907 . . . . 1.82 108.55 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 21.2 m -125.16 16.33 4.37 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.628 -0.67 . . . . 0.3 110.607 -179.354 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.43 155.47 15.15 Favored Glycine 0 N--CA 1.495 2.624 0 C-N-CA 118.924 -1.607 . . . . 0.17 110.994 179.679 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.484 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 1.3 tp10 -168.0 149.32 5.23 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 108.619 -0.882 . . . . 1.93 108.619 179.703 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.484 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.0 p90 -168.5 158.86 9.85 Favored 'General case' 0 N--CA 1.496 1.872 0 O-C-N 121.134 -0.979 . . . . 0.14 109.434 178.256 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.1 p -127.19 162.33 26.41 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.388 -0.82 . . . . 0.12 110.335 -179.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.487 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.44 142.77 6.46 Favored Glycine 0 N--CA 1.503 3.119 0 N-CA-C 109.985 -1.246 . . . . 0.12 109.985 179.128 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.443 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -77.27 64.53 2.69 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.028 -1.278 . . . . 0.18 110.208 -179.642 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.61 97.82 5.93 Favored 'General case' 0 N--CA 1.5 2.031 0 N-CA-C 108.264 -1.013 . . . . 0.88 108.264 178.647 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -69.9 -32.63 71.05 Favored 'General case' 0 N--CA 1.492 1.626 0 O-C-N 121.185 -0.947 . . . . 1.06 111.461 -179.313 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -63.46 -30.82 71.88 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 120.975 -1.078 . . . . 1.61 109.371 -179.717 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.94 -34.7 75.13 Favored 'General case' 0 C--N 1.296 -1.736 0 CA-C-O 121.323 0.582 . . . . 1.45 109.58 -178.982 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.626 HD21 ' CD1' ' A' ' 77' ' ' PHE . 58.9 mt -59.53 -37.81 79.34 Favored 'General case' 0 C--N 1.303 -1.423 0 CA-C-O 122.039 0.923 . . . . 0.19 108.574 179.328 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.3 tt0 -64.09 -42.04 97.07 Favored 'General case' 0 C--N 1.296 -1.745 0 C-N-CA 120.3 -0.56 . . . . 2.1 111.425 -178.062 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -43.94 77.42 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.961 -1.087 . . . . 0.19 111.565 -178.014 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.3 m -65.75 -38.91 90.4 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.834 -1.166 . . . . 0.2 109.72 -178.969 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.5 mt -59.93 -49.97 81.92 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.885 0 O-C-N 121.041 -1.037 . . . . 0.16 108.405 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.454 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.3 t-20 -60.14 -34.9 74.18 Favored 'General case' 0 C--N 1.297 -1.674 0 CA-C-O 122.091 0.948 . . . . 0.95 108.458 178.783 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 2.9 tm-20 -67.91 -39.88 83.51 Favored 'General case' 0 C--N 1.298 -1.669 0 O-C-N 121.574 -0.703 . . . . 2.21 109.938 -178.5 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.618 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.8 mt -99.52 -1.69 37.73 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.202 -0.936 . . . . 0.25 111.414 -179.168 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.475 HG13 ' O ' ' A' ' 105' ' ' VAL . 9.2 p . . . . . 0 N--CA 1.496 1.872 0 O-C-N 120.297 -1.502 . . . . 1.08 109.1 -179.419 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 35.1 Cg_endo . . . . . 0 N--CA 1.496 1.631 0 CA-C-O 120.902 0.293 . . . . 1.46 112.311 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -99.14 115.79 29.85 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.162 -0.961 . . . . 0.88 109.142 179.654 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.468 ' O ' ' O ' ' B' ' 64' ' ' ILE . 29.4 m -109.32 130.08 55.5 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.61 -0.681 . . . . 0.7 109.26 -179.734 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 38.2 mt -67.49 -32.87 73.99 Favored 'General case' 0 N--CA 1.494 1.739 0 O-C-N 121.214 -0.929 . . . . 0.61 109.904 -179.933 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 66.5 mmtt -60.41 -25.97 66.34 Favored 'General case' 0 N--CA 1.492 1.653 0 O-C-N 121.302 -0.874 . . . . 1.31 109.839 -179.158 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.487 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.4 mm -128.88 139.86 50.78 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.313 0 N-CA-C 109.462 -0.57 . . . . 0.15 109.462 -179.622 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 7.8 m -100.22 127.77 46.43 Favored 'General case' 0 N--CA 1.498 1.949 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 178.574 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -79.47 142.37 35.91 Favored 'General case' 0 N--CA 1.497 1.919 0 O-C-N 120.811 -1.181 . . . . 0.2 111.161 -178.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.435 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 22.3 m95 -78.09 -12.19 59.97 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.254 -0.904 . . . . 0.21 109.435 179.372 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -55.25 -10.97 0.65 Allowed 'General case' 0 N--CA 1.491 1.586 0 N-CA-C 108.263 -1.014 . . . . 0.49 108.263 179.624 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.429 ' H ' ' C ' ' B' ' 67' ' ' TRP . 31.3 m -64.36 134.68 28.89 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.492 0 N-CA-C 109.161 -0.681 . . . . 1.04 109.161 179.653 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 54.1 m-20 -60.17 -38.02 81.92 Favored 'General case' 0 N--CA 1.488 1.468 0 O-C-N 121.073 -1.017 . . . . 1.36 109.018 179.854 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.155 0 N-CA-C 109.077 -1.609 . . . . 2.32 109.077 -179.513 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.3 tpt . . . . . 0 N--CA 1.488 1.468 0 N-CA-C 109.092 -0.707 . . . . 2.88 109.092 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.3 t -98.11 145.44 9.64 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.272 -0.893 . . . . 0.45 109.471 -179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.2 tptm -130.07 128.29 41.61 Favored 'General case' 0 N--CA 1.5 2.041 0 N-CA-C 108.214 -1.032 . . . . 1.67 108.214 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 56.4 tt0 -97.07 125.23 41.39 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.202 -0.937 . . . . 0.31 109.341 179.809 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.8 mm -103.64 115.76 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.63 0 N-CA-C 108.663 -0.866 . . . . 0.19 108.663 179.221 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 41.7 mm-40 -99.32 -0.16 41.73 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.137 -0.977 . . . . 2.25 109.778 -179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -152.87 155.58 37.34 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 120.726 -1.234 . . . . 0.15 111.068 -179.984 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 11.7 ttpp -65.0 -31.5 72.77 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 108.461 -0.94 . . . . 1.65 108.461 178.449 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.5 m -58.65 -47.99 82.57 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.421 -0.799 . . . . 0.23 109.157 -179.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.68 -28.74 66.11 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 121.277 -0.889 . . . . 0.17 109.143 178.756 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.504 ' CE2' HD11 ' A' ' 15' ' ' LEU . 50.4 t80 -60.05 -44.37 94.74 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.098 -1.001 . . . . 0.14 108.741 -179.648 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 89.1 mm-40 -64.75 -43.04 94.6 Favored 'General case' 0 C--N 1.295 -1.798 0 N-CA-C 108.855 -0.795 . . . . 1.31 108.855 179.841 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.4 mm-40 -65.01 -36.49 84.56 Favored 'General case' 0 N--CA 1.489 1.524 0 CA-C-O 121.203 0.525 . . . . 1.77 110.487 179.805 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.08 -42.05 80.96 Favored 'General case' 0 C--N 1.303 -1.429 0 O-C-N 121.266 -0.896 . . . . 0.15 109.221 -179.487 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.504 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.6 mt -60.26 -40.1 89.16 Favored 'General case' 0 C--N 1.303 -1.415 0 N-CA-C 108.602 -0.888 . . . . 0.17 108.602 -179.927 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 17.5 t0 -67.98 -36.78 80.6 Favored 'General case' 0 N--CA 1.491 1.582 0 CA-C-O 121.485 0.66 . . . . 1.07 110.337 179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.71 -39.2 84.38 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.485 -0.759 . . . . 0.18 110.56 -178.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.89 -32.16 71.62 Favored 'General case' 0 C--N 1.299 -1.621 0 O-C-N 121.234 -0.916 . . . . 0.17 109.45 -179.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 69.09 -124.91 17.83 Favored Glycine 0 N--CA 1.489 2.212 0 N-CA-C 109.809 -1.316 . . . . 0.2 109.809 -179.68 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.7 m-20 -91.77 4.02 53.77 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.109 -1.23 . . . . 1.07 110.367 -179.288 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 58.9 mttm -76.2 147.89 38.1 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.047 -1.033 . . . . 1.5 109.482 -179.641 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.646 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -59.25 158.69 8.7 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.249 -1.389 . . . . 0.47 107.249 -179.806 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.644 ' H ' HD23 ' A' ' 22' ' ' LEU . 88.3 t -146.07 113.09 1.17 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.62 0 O-C-N 120.633 -1.292 . . . . 0.17 108.873 179.777 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.42 HG22 ' CE2' ' A' ' 79' ' ' PHE . 41.1 t -99.69 141.33 17.11 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 108.401 -0.962 . . . . 0.14 108.401 179.839 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 37.8 t -124.1 123.72 67.28 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.294 0 O-C-N 121.196 -0.94 . . . . 0.13 109.681 -179.511 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.535 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.8 t70 -100.98 116.66 33.34 Favored 'General case' 0 N--CA 1.505 2.285 0 O-C-N 121.407 -0.808 . . . . 1.05 110.687 179.847 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.2 m-85 -94.41 24.2 4.68 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.23 -0.919 . . . . 0.73 110.991 179.447 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.1 m -59.56 149.28 30.48 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 120.756 -1.215 . . . . 0.3 110.647 -178.871 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.746 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.06 124.8 32.17 Favored 'General case' 0 C--N 1.305 -1.365 0 N-CA-C 107.175 -1.417 . . . . 0.22 107.175 178.497 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.35 -30.38 70.76 Favored 'General case' 0 C--N 1.3 -1.573 0 C-N-CA 118.896 -1.121 . . . . 0.3 108.042 -179.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.746 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.0 p-90 -75.7 -13.85 60.33 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.423 -0.798 . . . . 0.26 110.741 179.984 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.429 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 23.3 t -85.78 118.3 25.19 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 120.745 -1.222 . . . . 0.26 108.225 -179.895 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.42 -54.08 38.98 Favored Glycine 0 N--CA 1.491 2.303 0 C-N-CA 120.73 -0.748 . . . . 0.23 112.265 -177.944 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.7 Cg_endo -60.44 -29.86 89.6 Favored 'Trans proline' 0 C--N 1.314 -1.283 0 CA-C-N 119.539 1.669 . . . . 0.31 112.183 -179.42 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.403 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -76.2 -47.77 22.87 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.015 -1.053 . . . . 0.24 109.726 179.801 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 53.9 tttm -60.05 -32.11 70.61 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.252 -0.905 . . . . 1.59 109.787 179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.409 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 44.6 ttm -59.93 -29.3 68.29 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.506 -0.746 . . . . 2.1 110.12 -179.475 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 7.6 mt -79.76 -4.52 7.23 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.998 0 O-C-N 121.701 -0.624 . . . . 0.49 111.026 -179.484 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.532 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.53 -31.24 8.53 Favored Pre-proline 0 N--CA 1.497 1.889 0 O-C-N 120.188 -1.57 . . . . 0.8 113.712 -177.356 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.532 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.1 Cg_exo -59.63 -38.85 79.19 Favored 'Trans proline' 0 N--CA 1.492 1.393 0 CA-C-N 121.756 1.663 . . . . 0.28 112.159 -178.395 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.9 m-85 -71.23 -50.69 30.36 Favored 'General case' 0 N--CA 1.489 1.495 0 C-N-CA 118.763 -1.175 . . . . 0.37 108.894 179.574 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 85.5 t80 -59.97 -47.35 86.18 Favored 'General case' 0 C--N 1.295 -1.77 0 O-C-N 121.099 -1.001 . . . . 0.16 109.178 179.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 53.5 t60 -68.91 -42.37 76.97 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.588 -0.695 . . . . 0.32 111.282 179.547 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.419 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 66.3 m -65.91 -39.15 90.33 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 120.905 -1.122 . . . . 0.22 110.622 -179.23 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 36.3 mt -59.93 -22.46 62.47 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.201 -0.937 . . . . 0.22 110.308 -178.584 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -56.76 -35.27 68.44 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 120.855 -1.153 . . . . 0.16 108.835 -179.21 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.6 mp0 -89.48 -12.62 39.57 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.957 -1.089 . . . . 2.16 109.503 179.26 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 20.3 ttmm -81.84 -36.08 28.68 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.182 -1.414 . . . . 1.78 107.182 178.572 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -122.09 67.34 0.92 Allowed 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 107.284 -1.376 . . . . 0.25 107.284 178.577 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 46.4 p -63.61 -7.03 6.17 Favored 'General case' 0 C--N 1.306 -1.302 0 N-CA-C 107.841 -1.17 . . . . 0.22 107.841 179.922 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 1.8 t-20 -80.19 -20.0 45.76 Favored 'General case' 0 N--CA 1.485 1.309 0 N-CA-C 109.231 -0.655 . . . . 1.13 109.231 178.408 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.544 HG13 ' HB3' ' A' ' 22' ' ' LEU . 78.7 t -110.54 147.69 14.52 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.291 0 N-CA-C 108.881 -0.785 . . . . 0.24 108.881 -178.975 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.0 mm -100.1 120.51 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.968 0 O-C-N 121.2 -0.937 . . . . 0.15 109.325 -179.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.576 ' C ' HD12 ' A' ' 55' ' ' LEU . 24.4 m-85 -98.38 126.97 44.11 Favored 'General case' 0 N--CA 1.503 2.181 0 O-C-N 121.168 -0.957 . . . . 0.12 110.393 179.689 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -110.31 143.69 40.14 Favored 'General case' 0 N--CA 1.503 2.205 0 N-CA-C 108.616 -0.883 . . . . 0.22 108.616 178.46 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -112.33 129.4 56.31 Favored 'General case' 0 N--CA 1.491 1.596 0 N-CA-C 106.809 -1.552 . . . . 1.13 106.809 178.626 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 38.5 t -126.93 133.39 68.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.237 -0.914 . . . . 0.15 110.495 -178.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.521 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 51.5 t0 -96.92 120.07 36.58 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.848 -0.797 . . . . 1.05 108.848 179.724 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 33.8 m -67.92 -18.88 24.2 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.535 0 O-C-N 120.592 -1.318 . . . . 0.16 107.739 179.305 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.2 m-20 -90.45 -43.89 9.98 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.504 -0.747 . . . . 1.08 111.599 -178.84 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.409 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 23.9 m-20 -95.75 -19.04 19.97 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.625 -1.297 . . . . 1.07 108.81 -179.954 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.521 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -119.61 38.75 3.8 Favored 'General case' 0 N--CA 1.49 1.551 0 N-CA-C 107.641 -1.244 . . . . 0.14 107.641 179.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -60.08 -22.56 62.89 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.835 -0.541 . . . . 1.47 109.933 -178.502 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.617 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.4 p30 -65.42 -38.32 89.57 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 120.76 -1.213 . . . . 1.05 108.84 179.281 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.617 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -71.41 -44.03 72.26 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.373 0 O-C-N 121.234 -0.916 . . . . 0.35 109.647 -179.982 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.65 -39.52 73.59 Favored 'General case' 0 N--CA 1.487 1.378 0 O-C-N 121.442 -0.787 . . . . 0.26 110.438 -178.866 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.0 p -60.83 -34.0 73.88 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 120.922 -1.111 . . . . 0.24 109.446 -179.535 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 75.0 tt0 -62.47 -37.77 87.26 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.288 -0.882 . . . . 2.06 109.184 179.386 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.25 0.02 57.1 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.347 -0.845 . . . . 0.23 110.929 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 43.0 mp0 53.61 49.85 18.49 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 120.946 -1.096 . . . . 2.02 109.025 -179.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 43.5 t -64.08 134.18 29.12 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.451 0 O-C-N 121.0 -1.063 . . . . 0.16 108.441 -179.205 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -105.44 -12.78 15.86 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.584 -0.698 . . . . 1.6 110.339 -178.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.61 154.44 18.36 Favored 'General case' 0 N--CA 1.491 1.594 0 O-C-N 120.819 -1.176 . . . . 0.14 111.116 179.652 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.4 p -125.8 156.11 71.73 Favored Pre-proline 0 N--CA 1.495 1.816 0 N-CA-C 107.359 -1.349 . . . . 0.15 107.359 178.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.0 Cg_endo -77.66 142.77 72.11 Favored 'Cis proline' 0 C--N 1.316 -1.17 0 C-N-CA 123.644 -1.399 . . . . 0.16 112.074 -2.177 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.9 134.04 48.11 Favored 'General case' 0 N--CA 1.498 1.94 0 N-CA-C 109.245 -0.65 . . . . 0.13 109.245 179.211 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.535 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 90.9 m-85 -110.7 130.49 55.56 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 108.72 -0.845 . . . . 0.2 108.72 179.714 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.4 mt-30 -120.63 140.26 51.81 Favored 'General case' 0 N--CA 1.499 2.008 0 N-CA-C 108.397 -0.964 . . . . 0.29 108.397 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.424 ' CE1' HG21 ' A' ' 100' ' ' THR . 76.0 m-85 -107.71 132.12 53.7 Favored 'General case' 0 C--N 1.299 -1.615 0 CA-C-O 121.466 0.651 . . . . 0.14 110.388 -179.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -125.79 144.11 50.78 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.803 -0.814 . . . . 0.15 108.803 179.248 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.0 tttp -147.07 128.51 14.96 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 107.208 -1.404 . . . . 1.68 107.208 179.49 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 84.2 mttt 60.01 28.03 17.51 Favored 'General case' 0 C--N 1.3 -1.581 0 N-CA-C 108.129 -1.063 . . . . 1.22 108.129 -178.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.19 21.66 75.32 Favored Glycine 0 N--CA 1.488 2.14 0 N-CA-C 110.133 -1.187 . . . . 0.23 110.133 -179.575 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.5 mm100 -128.72 137.75 51.76 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.291 -1.123 . . . . 2.07 111.012 179.967 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -77.43 125.3 29.12 Favored 'General case' 0 N--CA 1.494 1.757 0 O-C-N 121.46 -0.775 . . . . 1.82 109.63 179.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -123.97 9.1 4.93 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.956 0 O-C-N 121.617 -0.677 . . . . 0.3 110.887 -179.443 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.62 154.47 12.31 Favored Glycine 0 N--CA 1.496 2.695 0 C-N-CA 118.424 -1.846 . . . . 0.17 111.538 -179.978 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 50.5 tt0 -166.54 150.34 7.26 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.635 -0.921 . . . . 1.93 109.488 179.34 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.4 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 27.0 p90 -164.33 161.94 22.05 Favored 'General case' 0 N--CA 1.495 1.781 0 C-N-CA 119.273 -0.971 . . . . 0.14 109.159 177.111 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -126.64 159.96 32.1 Favored 'General case' 0 N--CA 1.496 1.826 0 CA-C-O 121.669 0.747 . . . . 0.12 109.539 -179.517 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.439 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.09 142.85 6.38 Favored Glycine 0 N--CA 1.494 2.51 0 N-CA-C 108.897 -1.681 . . . . 0.12 108.897 179.72 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.98 67.86 4.79 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.151 -1.205 . . . . 0.18 110.142 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.51 97.19 5.53 Favored 'General case' 0 N--CA 1.498 1.937 0 N-CA-C 108.417 -0.957 . . . . 0.88 108.417 178.789 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.56 -35.43 77.4 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.098 -1.001 . . . . 1.06 111.335 -179.476 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 71.0 mm-40 -61.81 -29.95 70.5 Favored 'General case' 0 C--N 1.3 -1.544 0 O-C-N 120.982 -1.074 . . . . 1.61 109.388 179.823 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 80.0 tttt -62.46 -33.61 75.16 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.75 -0.594 . . . . 1.45 109.404 -179.402 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.42 HD21 ' CD1' ' A' ' 77' ' ' PHE . 38.5 mt -59.27 -39.72 83.8 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.974 -1.121 . . . . 0.19 107.974 179.411 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.0 tt0 -60.88 -44.06 97.62 Favored 'General case' 0 C--N 1.298 -1.657 0 C-N-CA 119.456 -0.898 . . . . 2.1 110.907 -178.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -44.89 75.32 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 120.89 -1.131 . . . . 0.19 110.732 -178.359 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.424 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.8 m -64.75 -40.59 95.55 Favored 'General case' 0 C--N 1.302 -1.464 0 O-C-N 120.833 -1.167 . . . . 0.2 109.015 -179.361 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 77.6 mt -64.46 -47.85 87.59 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.827 0 N-CA-C 107.586 -1.264 . . . . 0.16 107.586 178.282 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.441 ' O ' HG12 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -59.99 -36.4 77.11 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.48 -0.933 . . . . 0.95 108.48 178.94 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.9 tp10 -69.33 -40.23 77.71 Favored 'General case' 0 C--N 1.3 -1.576 0 O-C-N 121.684 -0.635 . . . . 2.21 110.483 -178.702 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HB2' HD11 ' A' ' 22' ' ' LEU . 94.2 mt -98.22 -2.91 38.61 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.245 -0.91 . . . . 0.25 111.554 -178.514 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.441 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.497 1.916 0 O-C-N 120.418 -1.426 . . . . 1.08 109.289 -179.804 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo . . . . . 0 N--CA 1.493 1.448 0 CA-C-O 120.907 0.294 . . . . 1.46 112.333 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.34 123.1 38.69 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.918 -1.114 . . . . 0.88 109.286 179.515 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.536 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.4 m -110.49 130.65 55.51 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.464 -0.772 . . . . 0.7 108.93 179.627 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.4 mt -63.76 -25.21 68.08 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.303 -0.873 . . . . 0.61 109.287 -179.934 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.536 ' H ' HG22 ' B' ' 61' ' ' THR . 68.6 mmtt -61.49 -19.4 62.01 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.316 -0.865 . . . . 1.31 108.754 -179.453 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.439 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.6 mm -130.22 140.36 49.08 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.352 0 N-CA-C 109.375 -0.602 . . . . 0.15 109.375 -179.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.8 m -100.83 130.06 46.79 Favored 'General case' 0 N--CA 1.501 2.096 0 N-CA-C 106.779 -1.563 . . . . 0.19 106.779 177.492 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.1 m -81.99 145.57 30.18 Favored 'General case' 0 N--CA 1.504 2.262 0 O-C-N 120.664 -1.272 . . . . 0.2 111.509 -177.821 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.448 ' C ' ' N ' ' B' ' 69' ' ' VAL . 24.7 m95 -80.0 -17.75 52.04 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.411 -0.806 . . . . 0.21 109.563 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.412 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.2 m120 -55.98 -12.0 1.27 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.176 -1.046 . . . . 0.49 108.176 179.626 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.448 ' N ' ' C ' ' B' ' 67' ' ' TRP . 7.5 p -64.9 139.37 21.51 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.632 0 N-CA-C 109.068 -0.715 . . . . 1.04 109.068 -179.919 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -59.91 -39.03 84.04 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.094 -1.003 . . . . 1.36 109.769 -179.242 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . 0.422 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.489 2.221 0 N-CA-C 109.429 -1.468 . . . . 2.32 109.429 -179.553 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.0 mmt . . . . . 0 N--CA 1.491 1.605 0 N-CA-C 109.259 -0.645 . . . . 2.88 109.259 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.8 t -98.71 141.48 16.33 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.125 0 O-C-N 121.361 -0.837 . . . . 0.45 109.86 -179.318 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 24.1 tptp -130.43 129.54 43.15 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 121.287 -0.883 . . . . 1.67 108.916 -179.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.423 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 66.3 tt0 -96.52 124.48 40.52 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 107.777 -1.194 . . . . 0.31 107.777 178.497 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.9 mm -102.03 115.06 43.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.505 0 O-C-N 121.285 -0.884 . . . . 0.19 108.893 179.92 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.423 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 30.9 mm-40 -99.17 -1.58 38.96 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.289 -0.882 . . . . 2.25 109.279 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 78.9 p -150.13 152.7 35.14 Favored 'General case' 0 N--CA 1.496 1.867 0 O-C-N 121.13 -0.981 . . . . 0.15 110.993 -179.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.461 ' NZ ' ' CB ' ' A' ' 8' ' ' LYS . 2.9 ttmp? -62.83 -31.02 71.95 Favored 'General case' 0 C--N 1.304 -1.39 0 N-CA-C 108.54 -0.911 . . . . 1.65 108.54 178.372 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.6 m -58.16 -48.62 79.72 Favored 'General case' 0 N--CA 1.489 1.483 0 O-C-N 121.106 -0.996 . . . . 0.23 109.495 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.92 -31.06 70.56 Favored 'General case' 0 C--N 1.3 -1.584 0 O-C-N 121.257 -0.902 . . . . 0.17 108.872 179.37 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.531 ' CE2' HD11 ' A' ' 15' ' ' LEU . 50.1 t80 -59.79 -44.3 93.99 Favored 'General case' 0 N--CA 1.489 1.484 0 O-C-N 121.381 -0.825 . . . . 0.14 109.183 -179.88 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -65.6 -42.35 91.77 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.69 0.757 . . . . 1.31 109.166 -179.969 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -64.23 -39.1 93.26 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.641 -0.662 . . . . 1.77 110.226 179.683 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.32 -41.54 85.13 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.417 -0.802 . . . . 0.15 109.029 -179.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.531 HD11 ' CE2' ' A' ' 11' ' ' PHE . 71.4 mt -60.62 -40.15 90.8 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.239 -0.985 . . . . 0.17 108.357 179.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 18.5 t0 -69.52 -36.7 76.67 Favored 'General case' 0 N--CA 1.489 1.487 0 O-C-N 121.235 -0.916 . . . . 1.07 109.872 179.653 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.95 -36.51 78.02 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.299 -0.876 . . . . 0.18 110.335 -179.181 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.75 -33.59 75.46 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.263 -0.898 . . . . 0.17 109.383 179.96 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -124.58 20.44 Favored Glycine 0 N--CA 1.489 2.232 0 N-CA-C 110.345 -1.102 . . . . 0.2 110.345 179.746 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 80.0 m-20 -92.52 3.12 56.12 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.124 -1.221 . . . . 1.07 110.83 -178.915 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 60.3 mttt -75.14 150.74 38.66 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.106 -0.996 . . . . 1.5 108.767 -179.998 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.694 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -62.38 155.54 24.93 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 107.823 -1.177 . . . . 0.47 107.823 179.892 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.694 ' H ' HD23 ' A' ' 22' ' ' LEU . 46.8 t -142.84 113.17 2.49 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.415 0 O-C-N 121.128 -0.983 . . . . 0.17 108.695 179.768 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -102.08 140.97 19.22 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.596 0 N-CA-C 107.908 -1.145 . . . . 0.14 107.908 179.655 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 58.6 t -123.98 123.68 67.33 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.012 0 O-C-N 121.351 -0.843 . . . . 0.13 109.572 -179.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.529 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.4 t70 -100.62 109.25 21.31 Favored 'General case' 0 N--CA 1.492 1.673 0 O-C-N 121.573 -0.704 . . . . 1.05 110.922 -179.933 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.8 m-85 -91.0 101.28 14.05 Favored 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 106.575 -1.639 . . . . 0.73 106.575 176.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 73.2 m -128.14 146.48 50.69 Favored 'General case' 0 C--N 1.298 -1.642 0 N-CA-C 108.326 -0.99 . . . . 0.3 108.326 -179.772 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.564 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.95 123.63 30.17 Favored 'General case' 0 C--N 1.294 -1.828 0 N-CA-C 107.164 -1.421 . . . . 0.22 107.164 178.905 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.0 -32.09 73.08 Favored 'General case' 0 C--N 1.297 -1.717 0 C-N-CA 118.522 -1.271 . . . . 0.3 108.545 -179.34 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.564 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.2 p-90 -70.57 -26.16 63.4 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.257 -0.902 . . . . 0.26 110.636 179.313 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -83.78 115.98 22.49 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 120.959 -1.088 . . . . 0.26 108.134 -179.574 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.468 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -63.28 -50.05 65.85 Favored Glycine 0 N--CA 1.489 2.182 0 C-N-CA 120.622 -0.799 . . . . 0.23 111.713 -178.118 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.468 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 38.6 Cg_exo -52.13 -35.88 64.17 Favored 'Trans proline' 0 C--N 1.308 -1.579 0 CA-C-N 118.913 1.357 . . . . 0.31 111.98 -179.462 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.81 -53.83 7.87 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.434 -0.792 . . . . 0.24 110.029 179.99 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 21.0 ttpp -61.11 -37.21 81.96 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.06 -1.025 . . . . 1.59 109.867 179.704 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.497 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.6 tmm? -59.2 -28.17 66.41 Favored 'General case' 0 N--CA 1.495 1.792 0 O-C-N 121.569 -0.707 . . . . 2.1 109.878 -178.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.583 HG22 ' O ' ' A' ' 38' ' ' ILE . 72.9 mt -81.69 -3.86 7.24 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 O-C-N 121.838 -0.539 . . . . 0.49 111.332 -179.722 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -64.88 -27.6 2.37 Favored Pre-proline 0 N--CA 1.494 1.727 0 O-C-N 120.368 -1.458 . . . . 0.8 113.865 -178.022 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.2 Cg_exo -56.15 -40.69 83.23 Favored 'Trans proline' 0 N--CA 1.494 1.539 0 CA-C-N 122.215 1.827 . . . . 0.28 112.604 -176.642 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 53.1 m-85 -67.92 -45.21 75.01 Favored 'General case' 0 C--N 1.299 -1.611 0 C-N-CA 117.817 -1.553 . . . . 0.37 107.877 179.012 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.5 t80 -60.29 -53.43 57.79 Favored 'General case' 0 C--N 1.298 -1.651 0 O-C-N 121.255 -0.903 . . . . 0.16 110.177 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.4 t60 -68.23 -40.09 82.13 Favored 'General case' 0 C--N 1.298 -1.662 0 O-C-N 121.517 -0.739 . . . . 0.32 110.598 -179.946 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.452 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 70.0 m -62.21 -38.96 91.16 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.093 -1.004 . . . . 0.22 110.096 -179.882 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 42.3 mt -61.13 -27.28 68.27 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.174 -0.954 . . . . 0.22 110.105 -179.311 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 58.7 m -50.72 -38.48 47.55 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 120.864 -1.147 . . . . 0.16 109.424 -179.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.4 mp0 -83.3 -13.17 55.72 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.967 -1.083 . . . . 2.16 109.377 179.797 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.457 ' HZ2' ' HB2' ' A' ' 48' ' ' LYS . 4.4 ttmp? -82.05 -36.91 27.22 Favored 'General case' 0 N--CA 1.496 1.841 0 N-CA-C 107.705 -1.22 . . . . 1.78 107.705 178.403 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 -123.44 65.82 1.01 Allowed 'General case' 0 N--CA 1.495 1.82 0 N-CA-C 106.509 -1.663 . . . . 0.25 106.509 177.867 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.9 p -62.56 -8.87 7.12 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.154 -1.054 . . . . 0.22 108.154 -179.627 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 34.3 t30 -89.9 8.44 32.18 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 108.48 -0.933 . . . . 1.13 108.48 179.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.458 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.2 t -127.27 148.93 31.98 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.675 0 N-CA-C 107.698 -1.223 . . . . 0.24 107.698 178.617 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' CD1' ' A' ' 55' ' ' LEU . 21.9 mm -99.88 121.08 50.15 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.049 -1.032 . . . . 0.15 109.945 -178.311 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.525 ' C ' HD12 ' A' ' 55' ' ' LEU . 55.6 m-85 -104.45 124.6 49.54 Favored 'General case' 0 N--CA 1.503 2.218 0 O-C-N 121.201 -0.937 . . . . 0.12 109.909 179.22 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.525 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.9 mp -110.5 143.62 40.58 Favored 'General case' 0 N--CA 1.508 2.458 0 O-C-N 120.952 -1.092 . . . . 0.22 109.833 178.755 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 56.2 tt0 -112.8 130.05 56.22 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 106.74 -1.578 . . . . 1.13 106.74 177.965 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.0 t -127.08 140.43 49.09 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 CA-C-O 121.916 0.865 . . . . 0.15 111.537 -177.458 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.489 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.3 t0 -102.7 118.07 36.03 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.633 -0.877 . . . . 1.05 108.633 179.073 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.0 m -69.73 -15.09 19.04 Favored 'Isoleucine or valine' 0 C--N 1.296 -1.721 0 O-C-N 120.697 -1.252 . . . . 0.16 108.794 179.543 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.403 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.6 m-20 -95.42 -41.69 8.86 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.457 -0.777 . . . . 1.08 111.047 -179.129 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 59.1 m-20 -97.53 -18.66 18.85 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 121.072 -1.018 . . . . 1.07 108.552 179.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.489 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -122.66 39.15 4.0 Favored 'General case' 0 N--CA 1.492 1.641 0 N-CA-C 107.223 -1.399 . . . . 0.14 107.223 178.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.785 HE21 ' H ' ' A' ' 64' ' ' ASP . 1.6 pm0 -60.16 -22.96 63.53 Favored 'General case' 0 C--N 1.302 -1.464 0 CA-C-N 115.779 -0.646 . . . . 1.47 110.019 -178.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.785 ' H ' HE21 ' A' ' 63' ' ' GLN . 2.1 p30 -63.2 -36.21 82.87 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 120.943 -1.098 . . . . 1.05 109.202 179.532 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.632 HG23 ' OD1' ' A' ' 64' ' ' ASP . 13.8 t -73.64 -43.91 53.77 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.568 0 O-C-N 121.465 -0.772 . . . . 0.35 109.71 179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.33 -39.06 68.47 Favored 'General case' 0 C--N 1.299 -1.588 0 O-C-N 121.768 -0.582 . . . . 0.26 111.309 -177.959 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 88.3 p -60.21 -38.78 84.38 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.978 -1.076 . . . . 0.24 109.946 -179.151 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.91 -36.5 84.13 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.135 -0.978 . . . . 2.06 109.206 179.542 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.03 -0.63 55.07 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 121.395 -0.816 . . . . 0.23 111.194 -179.185 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 54.69 49.84 17.16 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.939 -1.101 . . . . 2.02 109.785 -179.545 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.6 t -65.38 130.4 30.58 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.588 0 C-N-CA 118.329 -1.348 . . . . 0.16 108.276 -179.071 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 77.8 mttt -102.15 -12.71 17.85 Favored 'General case' 0 N--CA 1.488 1.447 0 O-C-N 121.72 -0.613 . . . . 1.6 110.237 -178.989 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.477 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.82 156.21 17.54 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 120.746 -1.221 . . . . 0.14 110.814 179.323 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.42 HG23 ' NE1' ' B' ' 67' ' ' TRP . 36.6 p -129.74 154.27 80.96 Favored Pre-proline 0 N--CA 1.504 2.23 0 N-CA-C 108.06 -1.089 . . . . 0.15 108.06 178.903 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.6 Cg_endo -74.8 144.95 82.59 Favored 'Cis proline' 0 N--CA 1.496 1.665 0 C-N-CA 123.811 -1.329 . . . . 0.16 112.435 -2.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.477 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -130.33 136.12 48.79 Favored 'General case' 0 N--CA 1.501 2.076 0 N-CA-C 108.57 -0.9 . . . . 0.13 108.57 178.638 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.84 ' CD1' HD21 ' A' ' 97' ' ' LEU . 88.5 m-85 -109.68 129.54 55.59 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.663 -0.648 . . . . 0.2 109.313 -179.312 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.7 mt-30 -121.96 137.58 54.74 Favored 'General case' 0 N--CA 1.499 1.995 0 N-CA-C 108.683 -0.858 . . . . 0.29 108.683 179.614 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.6 m-85 -105.26 133.77 49.48 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 121.735 -0.603 . . . . 0.14 110.271 -179.336 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.1 m-85 -127.43 143.96 51.13 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 109.357 -0.609 . . . . 0.15 109.357 179.484 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.5 ttmt -145.92 127.13 14.77 Favored 'General case' 0 N--CA 1.493 1.684 0 N-CA-C 107.868 -1.16 . . . . 1.68 107.868 179.643 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.2 mttt 59.75 28.51 17.98 Favored 'General case' 0 N--CA 1.498 1.959 0 N-CA-C 108.211 -1.033 . . . . 1.22 108.211 -178.515 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.07 22.52 73.79 Favored Glycine 0 N--CA 1.488 2.117 0 N-CA-C 109.757 -1.337 . . . . 0.23 109.757 -179.42 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.4 mm100 -127.75 137.26 52.37 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.347 -1.09 . . . . 2.07 110.61 -179.996 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? -81.04 126.31 31.26 Favored 'General case' 0 N--CA 1.504 2.24 0 O-C-N 121.202 -0.936 . . . . 1.82 109.76 179.24 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.3 m -123.26 8.33 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.925 0 O-C-N 121.671 -0.643 . . . . 0.3 110.399 179.957 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.89 155.98 16.86 Favored Glycine 0 N--CA 1.497 2.751 0 C-N-CA 118.626 -1.749 . . . . 0.17 111.815 179.816 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -166.16 149.18 7.27 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.92 -0.753 . . . . 1.93 109.454 179.428 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.42 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 20.6 p90 -164.15 160.68 21.68 Favored 'General case' 0 N--CA 1.492 1.647 0 C-N-CA 119.08 -1.048 . . . . 0.14 109.459 177.927 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -124.96 162.79 23.72 Favored 'General case' 0 N--CA 1.497 1.88 0 CA-C-O 121.615 0.722 . . . . 0.12 109.86 -179.388 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.523 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.55 137.57 5.53 Favored Glycine 0 N--CA 1.493 2.477 0 N-CA-C 109.135 -1.586 . . . . 0.12 109.135 -179.955 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.469 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.02 67.78 2.41 Favored 'General case' 0 C--N 1.302 -1.49 0 O-C-N 121.179 -1.189 . . . . 0.18 110.232 -179.302 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 21.0 t-20 -119.21 100.12 7.13 Favored 'General case' 0 N--CA 1.499 1.998 0 N-CA-C 108.256 -1.016 . . . . 0.88 108.256 178.162 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.455 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.89 -34.7 73.89 Favored 'General case' 0 C--N 1.298 -1.65 0 O-C-N 121.492 -0.755 . . . . 1.06 112.36 -178.413 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.3 mm-40 -64.03 -29.89 71.01 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 120.538 -1.351 . . . . 1.61 109.553 179.942 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 0.7 OUTLIER -59.83 -38.38 81.87 Favored 'General case' 0 N--CA 1.493 1.688 0 N-CA-C 108.926 -0.768 . . . . 1.45 108.926 -179.561 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.84 HD21 ' CD1' ' A' ' 77' ' ' PHE . 42.9 mt -57.76 -39.88 78.43 Favored 'General case' 0 C--N 1.297 -1.683 0 CA-C-O 121.853 0.835 . . . . 0.19 108.929 179.678 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.3 tm-20 -62.81 -41.59 99.36 Favored 'General case' 0 C--N 1.293 -1.873 0 C-N-CA 119.825 -0.75 . . . . 2.1 110.611 -178.027 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.01 77.28 Favored 'General case' 0 N--CA 1.497 1.907 0 O-C-N 121.106 -0.996 . . . . 0.19 111.861 -178.676 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -65.18 -39.58 93.09 Favored 'General case' 0 C--N 1.299 -1.592 0 O-C-N 120.544 -1.348 . . . . 0.2 109.67 -178.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.5 mt -61.05 -49.9 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.747 0 O-C-N 121.101 -0.999 . . . . 0.16 108.818 179.907 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 105' ' ' VAL . 24.0 t-20 -60.18 -34.39 73.53 Favored 'General case' 0 C--N 1.3 -1.547 0 N-CA-C 108.32 -0.992 . . . . 0.95 108.32 178.609 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.9 tm-20 -67.83 -38.5 83.28 Favored 'General case' 0 C--N 1.299 -1.602 0 O-C-N 121.696 -0.627 . . . . 2.21 109.752 -178.597 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.621 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.5 mt -101.99 -0.13 34.23 Favored 'General case' 0 N--CA 1.505 2.295 0 O-C-N 121.299 -0.875 . . . . 0.25 111.56 -179.066 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.432 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.3 p . . . . . 0 N--CA 1.494 1.739 0 O-C-N 120.377 -1.452 . . . . 1.08 109.232 -179.172 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_exo . . . . . 0 N--CA 1.494 1.524 0 CA-C-O 121.342 0.476 . . . . 1.46 112.282 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -86.31 128.58 34.94 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.134 -0.979 . . . . 0.88 109.61 179.929 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.433 ' O ' ' O ' ' B' ' 64' ' ' ILE . 24.8 m -111.57 129.27 56.12 Favored 'General case' 0 N--CA 1.498 1.932 0 O-C-N 121.526 -0.734 . . . . 0.7 109.159 179.997 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 85.1 mt -65.7 -30.25 70.9 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.204 -0.935 . . . . 0.61 109.59 179.945 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.405 ' H ' HG22 ' B' ' 61' ' ' THR . 62.1 mmtt -64.16 -20.3 65.91 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.376 -0.828 . . . . 1.31 109.49 -179.696 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.523 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.1 mm -130.25 140.47 48.8 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.388 0 O-C-N 121.865 -0.522 . . . . 0.15 110.057 -179.266 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 59.9 m -98.15 124.64 42.8 Favored 'General case' 0 N--CA 1.503 2.178 0 N-CA-C 107.325 -1.361 . . . . 0.19 107.325 177.616 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 60.9 m -77.65 141.55 39.36 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.942 -1.098 . . . . 0.2 111.575 -178.283 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.464 ' C ' ' N ' ' B' ' 69' ' ' VAL . 21.5 m95 -76.38 -9.57 58.75 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.305 -0.872 . . . . 0.21 109.274 178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.466 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.9 m120 -52.7 -11.52 0.22 Allowed 'General case' 0 N--CA 1.487 1.38 0 O-C-N 121.109 -0.994 . . . . 0.49 108.715 -179.893 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.464 ' N ' ' C ' ' B' ' 67' ' ' TRP . 23.4 m -61.01 145.09 13.01 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 O-C-N 121.367 -0.833 . . . . 1.04 109.692 179.869 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 68.1 m-20 -59.48 -36.8 76.71 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.231 -0.918 . . . . 1.36 109.624 -179.703 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.494 2.529 0 CA-C-O 117.903 -1.498 . . . . 2.32 109.685 179.723 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 92.2 mmm . . . . . 0 N--CA 1.49 1.563 0 N-CA-C 109.021 -0.733 . . . . 2.88 109.021 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 70.1 t -98.83 132.88 43.26 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.3 -0.875 . . . . 0.45 109.41 -179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.9 tptt -132.01 130.68 41.72 Favored 'General case' 0 N--CA 1.495 1.802 0 N-CA-C 108.617 -0.883 . . . . 1.67 108.617 179.927 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.5 tt0 -99.35 122.86 43.07 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 121.348 -0.845 . . . . 0.31 108.886 179.49 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.8 mm -101.69 115.25 43.13 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 O-C-N 121.372 -0.83 . . . . 0.19 108.792 179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.457 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 53.4 mp0 -97.52 -0.71 45.5 Favored 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.376 -0.827 . . . . 2.25 109.415 -179.584 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -154.0 153.11 31.38 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.021 -1.049 . . . . 0.15 111.198 -179.861 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.4 ttpt -62.84 -32.4 73.61 Favored 'General case' 0 C--N 1.304 -1.382 0 N-CA-C 108.445 -0.946 . . . . 1.65 108.445 178.879 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.3 m -58.96 -46.44 88.06 Favored 'General case' 0 C--N 1.303 -1.417 0 N-CA-C 107.999 -1.111 . . . . 0.23 107.999 -179.857 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.92 -30.7 69.22 Favored 'General case' 0 C--N 1.301 -1.534 0 N-CA-C 108.634 -0.876 . . . . 0.17 108.634 178.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.515 ' CE2' HD11 ' A' ' 15' ' ' LEU . 53.7 t80 -59.83 -43.79 94.39 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.109 -0.994 . . . . 0.14 108.964 179.743 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.0 mm100 -65.36 -41.29 94.0 Favored 'General case' 0 C--N 1.297 -1.716 0 N-CA-C 108.831 -0.803 . . . . 1.31 108.831 -179.905 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 -66.9 -35.34 79.79 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.663 -0.648 . . . . 1.77 110.237 179.922 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.01 -40.81 82.92 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 121.284 -0.885 . . . . 0.15 109.234 -179.69 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.515 HD11 ' CE2' ' A' ' 11' ' ' PHE . 69.3 mt -61.52 -40.39 94.45 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.334 -0.854 . . . . 0.17 108.807 179.709 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.7 t0 -70.05 -36.83 75.29 Favored 'General case' 0 N--CA 1.488 1.446 0 O-C-N 121.417 -0.802 . . . . 1.07 110.185 -179.993 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -65.95 -39.11 90.14 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.361 -0.837 . . . . 0.18 110.338 -178.801 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.38 -32.66 71.52 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.381 -0.824 . . . . 0.17 109.847 -179.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.08 -126.8 23.75 Favored Glycine 0 N--CA 1.49 2.297 0 N-CA-C 110.31 -1.116 . . . . 0.2 110.31 -179.743 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.9 m-20 -91.75 5.27 50.45 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 120.892 -1.358 . . . . 1.07 110.978 -178.327 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.4 mttp -77.58 151.83 34.26 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 121.128 -0.983 . . . . 1.5 109.469 179.72 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.677 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -61.03 156.91 16.76 Favored 'General case' 0 N--CA 1.485 1.322 0 N-CA-C 107.489 -1.3 . . . . 0.47 107.489 179.78 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.675 ' H ' HD23 ' A' ' 22' ' ' LEU . 77.8 t -143.75 117.99 3.71 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.545 0 O-C-N 120.856 -1.153 . . . . 0.17 108.859 -179.958 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 25.3 t -107.0 142.08 20.65 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 107.813 -1.18 . . . . 0.14 107.813 179.277 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.2 t -124.45 123.76 66.91 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.914 0 O-C-N 121.351 -0.843 . . . . 0.13 109.205 -179.256 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.473 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.1 t70 -100.82 118.1 36.22 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.473 -0.767 . . . . 1.05 109.633 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.7 m-85 -95.18 22.8 6.32 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 121.306 -0.871 . . . . 0.73 109.902 179.753 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.444 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.3 m -59.04 148.01 32.52 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.027 -1.045 . . . . 0.3 110.779 -178.452 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.583 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.13 123.82 32.6 Favored 'General case' 0 C--N 1.304 -1.409 0 N-CA-C 108.074 -1.084 . . . . 0.22 108.074 179.233 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.0 t -65.26 -34.51 78.52 Favored 'General case' 0 C--N 1.298 -1.666 0 C-N-CA 118.916 -1.114 . . . . 0.3 108.192 -179.916 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.583 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.0 p-90 -70.12 -23.28 63.0 Favored 'General case' 0 N--CA 1.497 1.877 0 O-C-N 121.218 -0.927 . . . . 0.26 111.003 179.032 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 14.2 t -82.68 112.89 19.96 Favored 'General case' 0 N--CA 1.492 1.646 0 O-C-N 120.734 -1.229 . . . . 0.26 107.992 -179.829 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.455 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.85 -50.58 66.17 Favored Glycine 0 N--CA 1.489 2.211 0 C-N-CA 120.329 -0.939 . . . . 0.23 111.246 -178.376 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.455 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 37.1 Cg_exo -51.45 -37.82 62.51 Favored 'Trans proline' 0 C--N 1.31 -1.463 0 CA-C-N 119.011 1.406 . . . . 0.31 111.958 179.668 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.444 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.49 -47.5 19.47 Favored 'General case' 0 N--CA 1.492 1.634 0 O-C-N 121.057 -1.027 . . . . 0.24 109.909 -179.877 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 80.1 tttt -59.54 -31.52 69.49 Favored 'General case' 0 N--CA 1.495 1.81 0 O-C-N 121.135 -0.978 . . . . 1.59 109.127 179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.511 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -59.91 -29.74 68.57 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.473 -0.767 . . . . 2.1 109.967 -179.973 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.558 HD11 ' HB1' ' A' ' 92' ' ' ALA . 15.5 mt -80.78 -5.07 8.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.881 0 O-C-N 121.523 -0.736 . . . . 0.49 111.325 -179.073 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.526 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.28 -31.52 9.36 Favored Pre-proline 0 N--CA 1.496 1.85 0 O-C-N 119.988 -1.695 . . . . 0.8 113.669 -176.857 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.526 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.2 Cg_exo -59.9 -37.46 85.66 Favored 'Trans proline' 0 N--CA 1.491 1.374 0 CA-C-N 121.898 1.714 . . . . 0.28 112.067 -178.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 49.6 m-85 -71.62 -51.4 23.41 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 118.371 -1.332 . . . . 0.37 108.175 179.57 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -59.87 -46.7 88.46 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.38 -0.825 . . . . 0.16 109.039 179.057 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 51.5 t60 -68.14 -45.65 73.02 Favored 'General case' 0 C--N 1.296 -1.72 0 O-C-N 121.493 -0.755 . . . . 0.32 110.846 179.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.44 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.7 m -61.62 -39.92 93.0 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.085 -1.009 . . . . 0.22 111.154 -179.61 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.6 mt -61.33 -22.31 64.79 Favored 'General case' 0 N--CA 1.49 1.538 0 O-C-N 121.269 -0.894 . . . . 0.22 110.852 -177.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -55.51 -38.25 68.96 Favored 'General case' 0 C--N 1.302 -1.46 0 O-C-N 120.981 -1.074 . . . . 0.16 108.714 -179.631 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.4 mm-40 -86.21 -16.66 37.03 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.251 -0.905 . . . . 2.16 109.263 179.275 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 65.2 tttm -76.58 -35.75 57.96 Favored 'General case' 0 N--CA 1.491 1.616 0 N-CA-C 107.325 -1.361 . . . . 1.78 107.325 179.203 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.6 m-85 -123.9 67.92 1.04 Allowed 'General case' 0 N--CA 1.496 1.849 0 N-CA-C 107.552 -1.277 . . . . 0.25 107.552 177.957 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.7 p -64.06 -7.73 9.63 Favored 'General case' 0 C--N 1.304 -1.394 0 N-CA-C 108.578 -0.897 . . . . 0.22 108.578 -179.865 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 26.7 t30 -89.16 5.48 44.46 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 108.115 -1.069 . . . . 1.13 108.115 178.932 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.473 HG13 ' HB3' ' A' ' 22' ' ' LEU . 44.4 t -128.0 143.08 41.99 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.752 0 N-CA-C 107.605 -1.257 . . . . 0.24 107.605 178.796 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.5 mm -99.21 122.55 51.1 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 120.913 -1.117 . . . . 0.15 109.203 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.599 ' C ' HD12 ' A' ' 55' ' ' LEU . 29.8 m-85 -100.76 129.01 46.59 Favored 'General case' 0 N--CA 1.5 2.053 0 O-C-N 121.298 -0.876 . . . . 0.12 109.219 179.336 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.599 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -112.52 141.52 46.19 Favored 'General case' 0 N--CA 1.501 2.098 0 O-C-N 121.357 -0.839 . . . . 0.22 109.138 178.675 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -109.94 132.62 53.99 Favored 'General case' 0 C--N 1.302 -1.468 0 N-CA-C 106.673 -1.603 . . . . 1.13 106.673 178.089 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -130.45 132.0 64.91 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.27 -0.894 . . . . 0.15 110.26 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.665 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.6 t0 -95.64 120.96 36.81 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.205 -0.934 . . . . 1.05 108.52 179.145 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.1 m -67.87 -20.52 26.1 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.659 0 O-C-N 120.659 -1.276 . . . . 0.16 107.989 179.162 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.543 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.1 m-20 -90.25 -43.2 10.55 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 121.618 -0.676 . . . . 1.08 111.506 -178.818 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.411 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 72.4 m-20 -95.75 -14.2 23.54 Favored 'General case' 0 N--CA 1.506 2.366 0 O-C-N 120.561 -1.337 . . . . 1.07 108.237 179.177 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.665 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 39.72 3.9 Favored 'General case' 0 N--CA 1.491 1.607 0 N-CA-C 107.21 -1.404 . . . . 0.14 107.21 179.261 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.1 pt20 -60.08 -26.93 66.58 Favored 'General case' 0 C--N 1.298 -1.66 0 O-C-N 121.628 -0.67 . . . . 1.47 109.362 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.537 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -65.33 -37.48 87.21 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.029 -1.044 . . . . 1.05 108.969 179.666 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.537 HG23 ' OD1' ' A' ' 64' ' ' ASP . 7.6 t -70.28 -47.26 67.91 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 O-C-N 121.236 -0.915 . . . . 0.35 109.797 -179.889 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.33 -36.92 74.55 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.446 -0.784 . . . . 0.26 110.788 -178.695 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.9 p -61.07 -32.59 72.23 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.027 -1.046 . . . . 0.24 109.57 -179.034 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -66.9 -35.73 80.68 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.246 -0.908 . . . . 2.06 109.283 179.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.467 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -88.02 -0.22 56.76 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.281 -0.887 . . . . 0.23 110.857 -178.952 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.0 mp0 54.62 50.06 16.77 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.056 -1.027 . . . . 2.02 109.954 -179.86 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.2 t -67.45 132.38 32.49 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.476 0 O-C-N 120.938 -1.101 . . . . 0.16 108.731 -179.529 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.6 mmtt -104.6 -12.63 16.32 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.671 -0.643 . . . . 1.6 110.66 -178.556 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.493 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.8 153.42 16.77 Favored 'General case' 0 N--CA 1.497 1.902 0 O-C-N 120.499 -1.376 . . . . 0.14 110.841 179.698 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.2 p -124.84 155.26 70.43 Favored Pre-proline 0 N--CA 1.501 2.122 0 N-CA-C 108.038 -1.097 . . . . 0.15 108.038 179.085 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.6 Cg_endo -76.44 143.16 75.38 Favored 'Cis proline' 0 N--CA 1.493 1.457 0 C-N-CA 123.844 -1.315 . . . . 0.16 112.538 -2.914 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.493 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.9 m -128.97 136.12 49.92 Favored 'General case' 0 N--CA 1.494 1.769 0 N-CA-C 109.11 -0.7 . . . . 0.13 109.11 178.322 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.756 ' CD1' HD21 ' A' ' 97' ' ' LEU . 93.8 m-85 -112.01 129.64 56.13 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.778 -0.823 . . . . 0.2 108.778 179.941 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.467 HE22 ' HB1' ' A' ' 69' ' ' ALA . 63.0 mt-30 -121.49 137.75 54.59 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.843 -1.169 . . . . 0.29 107.843 179.429 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 83.3 m-85 -105.56 134.59 48.41 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.722 -0.611 . . . . 0.14 110.978 -178.286 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 86.5 m-85 -128.1 148.99 50.6 Favored 'General case' 0 N--CA 1.491 1.614 0 CA-C-O 121.47 0.653 . . . . 0.15 109.546 178.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.4 tttm -150.74 125.62 9.79 Favored 'General case' 0 C--N 1.303 -1.434 0 N-CA-C 107.74 -1.207 . . . . 1.68 107.74 179.449 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 55.1 mttp 60.03 28.17 17.68 Favored 'General case' 0 N--CA 1.501 2.101 0 N-CA-C 108.956 -0.757 . . . . 1.22 108.956 -178.776 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.2 21.46 70.38 Favored Glycine 0 N--CA 1.491 2.322 0 N-CA-C 110.113 -1.195 . . . . 0.23 110.113 -179.746 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -129.51 140.21 51.32 Favored 'General case' 0 N--CA 1.499 1.979 0 O-C-N 121.328 -1.101 . . . . 2.07 110.596 -179.808 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -77.79 129.12 35.05 Favored 'General case' 0 N--CA 1.497 1.879 0 O-C-N 121.551 -0.718 . . . . 1.82 109.063 179.758 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.4 m -123.24 8.03 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.781 0 O-C-N 121.683 -0.636 . . . . 0.3 110.39 -179.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 170.1 158.81 14.6 Favored Glycine 0 N--CA 1.497 2.704 0 C-N-CA 118.433 -1.842 . . . . 0.17 112.059 179.63 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -164.13 149.44 10.51 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 122.005 -0.703 . . . . 1.93 109.87 179.235 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.455 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 8.2 p90 -163.81 159.57 21.37 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.389 -0.82 . . . . 0.14 109.967 177.693 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.4 p -126.2 160.46 30.2 Favored 'General case' 0 N--CA 1.492 1.666 0 CA-C-O 121.867 0.842 . . . . 0.12 110.253 -179.294 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.492 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.34 140.78 5.6 Favored Glycine 0 N--CA 1.491 2.334 0 N-CA-C 108.652 -1.779 . . . . 0.12 108.652 179.827 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.558 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.32 62.91 3.8 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.184 -1.186 . . . . 0.18 110.193 -179.338 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.429 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.4 t-20 -117.48 101.82 8.69 Favored 'General case' 0 N--CA 1.499 2.003 0 N-CA-C 107.89 -1.152 . . . . 0.88 107.89 178.353 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.453 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.32 -31.45 69.93 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.484 -0.76 . . . . 1.06 111.747 -178.831 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.6 mt-10 -66.94 -29.56 69.46 Favored 'General case' 0 C--N 1.3 -1.563 0 O-C-N 120.721 -1.237 . . . . 1.61 109.551 -179.415 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.429 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 74.4 tttt -60.07 -34.09 72.97 Favored 'General case' 0 C--N 1.295 -1.788 0 N-CA-C 108.353 -0.98 . . . . 1.45 108.353 -179.25 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.756 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.1 mt -59.87 -40.04 87.3 Favored 'General case' 0 C--N 1.303 -1.44 0 N-CA-C 108.61 -0.885 . . . . 0.19 108.61 179.014 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 87.0 tt0 -63.09 -42.4 99.61 Favored 'General case' 0 C--N 1.296 -1.73 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.916 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.07 -43.55 78.33 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.185 -0.947 . . . . 0.19 111.278 -178.408 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.04 -39.31 90.06 Favored 'General case' 0 C--N 1.299 -1.619 0 O-C-N 120.753 -1.217 . . . . 0.2 109.873 -179.118 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.4 mt -61.38 -47.49 93.19 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.884 0 O-C-N 121.001 -1.062 . . . . 0.16 108.511 179.128 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.499 ' O ' HG12 ' A' ' 105' ' ' VAL . 18.9 t-20 -60.41 -35.63 76.24 Favored 'General case' 0 C--N 1.301 -1.5 0 CA-C-O 121.821 0.82 . . . . 0.95 108.922 178.819 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -67.29 -39.72 86.01 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.75 -0.594 . . . . 2.21 109.886 -178.592 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 22' ' ' LEU . 73.4 mt -99.35 -2.65 35.78 Favored 'General case' 0 N--CA 1.5 2.04 0 O-C-N 121.236 -0.915 . . . . 0.25 111.046 -179.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.499 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.3 p . . . . . 0 N--CA 1.498 1.953 0 O-C-N 120.521 -1.362 . . . . 1.08 109.019 -179.373 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 25.8 Cg_endo . . . . . 0 N--CA 1.496 1.642 0 CA-C-O 121.474 0.531 . . . . 1.46 111.718 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -90.1 124.95 35.24 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.403 -0.81 . . . . 0.88 108.993 179.913 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.41 HG22 ' H ' ' B' ' 63' ' ' LYS . 25.9 m -109.39 126.75 53.76 Favored 'General case' 0 N--CA 1.501 2.109 0 O-C-N 121.326 -0.859 . . . . 0.7 109.7 -179.221 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.6 mt -70.65 -25.97 63.24 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.433 -0.792 . . . . 0.61 109.936 179.504 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.41 ' H ' HG22 ' B' ' 61' ' ' THR . 28.9 mmtp -65.09 -17.8 64.76 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.441 -0.787 . . . . 1.31 109.283 -178.701 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.492 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.1 mm -129.29 140.1 50.06 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.48 0 O-C-N 121.813 -0.555 . . . . 0.15 109.821 -179.321 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.6 m -101.64 132.15 47.47 Favored 'General case' 0 N--CA 1.502 2.167 0 N-CA-C 107.725 -1.213 . . . . 0.19 107.725 178.072 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 65.0 m -81.66 141.55 33.54 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 120.726 -1.234 . . . . 0.2 110.994 -179.103 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.465 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.6 m95 -76.21 -12.55 60.11 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.292 -0.88 . . . . 0.21 108.904 178.598 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 3.0 m120 -53.33 -11.39 0.3 Allowed 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.36 -0.978 . . . . 0.49 108.36 179.61 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.458 ' N ' ' C ' ' B' ' 67' ' ' TRP . 13.8 m -60.44 139.6 19.65 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.442 0 C-N-CA 119.544 -0.862 . . . . 1.04 109.563 179.924 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -60.43 -37.43 80.88 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.572 -0.705 . . . . 1.36 110.259 179.739 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.402 0 CA-C-O 118.0 -1.444 . . . . 2.32 109.533 -179.18 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.3 mmm . . . . . 0 N--CA 1.492 1.627 0 N-CA-C 109.177 -0.675 . . . . 2.88 109.177 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 78.5 t -97.99 145.24 9.9 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.183 0 O-C-N 121.257 -0.902 . . . . 0.45 109.845 -179.664 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.4 tptt -129.56 125.34 36.03 Favored 'General case' 0 N--CA 1.493 1.722 0 N-CA-C 107.83 -1.174 . . . . 1.67 107.83 179.856 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -96.55 122.62 39.66 Favored 'General case' 0 N--CA 1.491 1.613 0 N-CA-C 108.847 -0.798 . . . . 0.31 108.847 -179.695 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.6 mm -100.9 111.95 32.22 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.675 0 N-CA-C 108.487 -0.931 . . . . 0.19 108.487 -179.865 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.458 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.9 mp0 -95.65 -0.44 51.7 Favored 'General case' 0 C--N 1.304 -1.375 0 O-C-N 121.138 -0.976 . . . . 2.25 109.844 -179.668 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.58 156.3 34.85 Favored 'General case' 0 N--CA 1.499 2.008 0 O-C-N 120.79 -1.194 . . . . 0.15 111.782 -179.912 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 27.2 ttpt -61.87 -31.7 71.99 Favored 'General case' 0 N--CA 1.489 1.496 0 N-CA-C 108.225 -1.028 . . . . 1.65 108.225 178.491 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.408 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 60.0 m -58.51 -49.91 75.67 Favored 'General case' 0 C--N 1.304 -1.402 0 C-N-CA 119.503 -0.879 . . . . 0.23 108.818 -179.505 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -29.03 67.59 Favored 'General case' 0 C--N 1.299 -1.597 0 N-CA-C 108.933 -0.766 . . . . 0.17 108.933 179.045 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.579 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.9 t80 -59.75 -44.52 93.8 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.133 -0.979 . . . . 0.14 109.351 179.923 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 91.0 mm-40 -65.01 -44.02 90.56 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 121.424 -0.797 . . . . 1.31 109.305 -179.652 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.533 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.84 -39.45 94.25 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 121.704 -0.623 . . . . 1.77 110.414 179.751 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.74 -42.19 95.36 Favored 'General case' 0 C--N 1.3 -1.579 0 O-C-N 121.374 -0.829 . . . . 0.15 109.057 -179.342 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.579 HD11 ' CE2' ' A' ' 11' ' ' PHE . 35.6 mt -60.25 -41.06 92.42 Favored 'General case' 0 C--N 1.306 -1.318 0 O-C-N 121.315 -0.866 . . . . 0.17 109.011 179.771 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -70.02 -36.16 74.87 Favored 'General case' 0 C--N 1.304 -1.387 0 O-C-N 121.359 -0.838 . . . . 1.07 110.474 179.903 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.6 -36.46 78.71 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.132 -0.98 . . . . 0.18 110.965 -178.304 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.62 -31.48 71.57 Favored 'General case' 0 N--CA 1.494 1.773 0 O-C-N 120.897 -1.127 . . . . 0.17 109.675 -179.713 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.95 -124.67 20.83 Favored Glycine 0 N--CA 1.49 2.247 0 N-CA-C 109.989 -1.244 . . . . 0.2 109.989 -179.754 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.426 ' CG ' ' NZ ' ' A' ' 82' ' ' LYS . 65.2 m-20 -91.85 0.33 57.49 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 120.999 -1.294 . . . . 1.07 110.706 -178.77 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 64.4 mttt -74.78 150.1 39.48 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 120.838 -1.164 . . . . 1.5 109.646 -179.418 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.424 HD23 ' HA ' ' A' ' 22' ' ' LEU . 8.2 mt -57.39 159.94 4.4 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.961 -1.087 . . . . 0.47 109.316 179.1 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 94.1 t -146.65 107.92 0.7 Allowed 'Isoleucine or valine' 0 C--N 1.305 -1.341 0 N-CA-C 108.102 -1.073 . . . . 0.17 108.102 179.298 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.449 HG22 ' CD2' ' A' ' 79' ' ' PHE . 47.6 t -102.46 136.26 35.63 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.673 0 N-CA-C 107.595 -1.261 . . . . 0.14 107.595 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.9 t -118.18 123.05 71.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.134 0 O-C-N 121.201 -0.937 . . . . 0.13 109.742 -178.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.524 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -98.97 119.78 38.31 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.42 -0.8 . . . . 1.05 109.928 179.85 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.5 m-85 -97.85 24.91 6.39 Favored 'General case' 0 N--CA 1.498 1.945 0 O-C-N 121.23 -0.919 . . . . 0.73 110.401 179.689 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -59.88 148.26 35.49 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.036 -1.04 . . . . 0.3 110.403 -178.858 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.587 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.39 124.54 32.11 Favored 'General case' 0 C--N 1.303 -1.424 0 N-CA-C 107.687 -1.227 . . . . 0.22 107.687 178.623 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.3 t -68.09 -33.61 74.86 Favored 'General case' 0 C--N 1.298 -1.638 0 C-N-CA 118.877 -1.129 . . . . 0.3 108.703 -179.96 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.587 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.4 p-90 -69.95 -21.63 63.25 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.147 -0.971 . . . . 0.26 110.447 179.471 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.1 t -84.59 112.01 20.04 Favored 'General case' 0 N--CA 1.493 1.676 0 O-C-N 120.974 -1.079 . . . . 0.26 108.342 -179.98 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.431 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.92 -52.05 55.57 Favored Glycine 0 N--CA 1.491 2.349 0 C-N-CA 120.862 -0.685 . . . . 0.23 111.64 -178.005 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.431 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -51.23 -35.28 52.21 Favored 'Trans proline' 0 C--N 1.309 -1.525 0 CA-C-N 119.062 1.431 . . . . 0.31 111.72 179.79 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.06 -48.66 17.24 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.587 -0.696 . . . . 0.24 109.816 -179.918 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.8 tttt -60.0 -32.15 70.59 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.28 -0.887 . . . . 1.59 109.533 179.559 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 19.1 ttt -59.81 -27.76 66.87 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.162 -0.961 . . . . 2.1 108.998 -179.673 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.405 HG22 ' O ' ' A' ' 38' ' ' ILE . 19.5 mt -82.2 -7.72 10.91 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.163 0 O-C-N 121.782 -0.574 . . . . 0.49 111.868 -179.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.529 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.93 -31.13 8.6 Favored Pre-proline 0 N--CA 1.495 1.784 0 O-C-N 119.858 -1.776 . . . . 0.8 114.168 -177.472 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.529 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.9 Cg_exo -58.61 -38.61 88.63 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.616 1.613 . . . . 0.28 112.579 -178.06 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.4 m-85 -69.29 -51.07 40.9 Favored 'General case' 0 C--N 1.303 -1.415 0 C-N-CA 118.773 -1.171 . . . . 0.37 108.954 179.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.5 t80 -59.63 -50.81 72.44 Favored 'General case' 0 C--N 1.298 -1.635 0 O-C-N 121.248 -0.908 . . . . 0.16 109.508 179.28 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -67.47 -44.24 79.07 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.744 -0.597 . . . . 0.32 111.522 179.962 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.453 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.5 -37.1 84.73 Favored 'General case' 0 N--CA 1.498 1.965 0 O-C-N 120.953 -1.092 . . . . 0.22 110.496 -179.756 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.3 mt -61.73 -25.42 67.43 Favored 'General case' 0 N--CA 1.491 1.579 0 O-C-N 121.318 -0.864 . . . . 0.22 110.315 -178.584 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.0 m -51.62 -38.35 54.27 Favored 'General case' 0 C--N 1.301 -1.516 0 O-C-N 121.075 -1.016 . . . . 0.16 108.633 -179.106 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.471 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -85.87 -17.03 36.72 Favored 'General case' 0 C--N 1.303 -1.44 0 O-C-N 121.4 -0.812 . . . . 2.16 109.415 179.951 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -77.66 -37.34 50.05 Favored 'General case' 0 N--CA 1.491 1.62 0 N-CA-C 107.594 -1.261 . . . . 1.78 107.594 179.009 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.0 m-85 -121.85 67.25 0.91 Allowed 'General case' 0 N--CA 1.496 1.862 0 N-CA-C 106.699 -1.593 . . . . 0.25 106.699 177.785 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 62.5 p -63.44 -10.1 15.74 Favored 'General case' 0 C--N 1.307 -1.275 0 N-CA-C 108.856 -0.794 . . . . 0.22 108.856 -179.467 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.3 t30 -90.99 8.84 33.26 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 108.6 -0.889 . . . . 1.13 108.6 179.279 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 70.0 t -127.12 145.72 34.2 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.672 0 N-CA-C 107.406 -1.331 . . . . 0.24 107.406 178.671 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.31 120.61 50.01 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.075 0 O-C-N 120.978 -1.076 . . . . 0.15 109.989 -178.79 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.5 ' C ' HD12 ' A' ' 55' ' ' LEU . 47.6 m-85 -102.96 127.78 50.05 Favored 'General case' 0 N--CA 1.506 2.33 0 O-C-N 121.006 -1.059 . . . . 0.12 109.891 179.277 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.5 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -110.06 141.4 42.95 Favored 'General case' 0 N--CA 1.509 2.523 0 O-C-N 120.984 -1.073 . . . . 0.22 109.489 178.524 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.7 tt0 -110.14 132.88 53.77 Favored 'General case' 0 N--CA 1.494 1.766 0 N-CA-C 107.316 -1.364 . . . . 1.13 107.316 178.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 39.6 t -130.23 131.92 65.38 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.162 0 O-C-N 121.157 -0.964 . . . . 0.15 110.839 -178.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.617 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.9 t0 -95.2 119.97 34.62 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.135 -1.061 . . . . 1.05 108.135 178.845 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -68.11 -20.1 25.37 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.806 0 C-N-CA 118.749 -1.181 . . . . 0.16 108.532 179.913 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.538 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.9 m-20 -91.72 -41.36 10.75 Favored 'General case' 0 N--CA 1.49 1.532 0 O-C-N 121.486 -0.759 . . . . 1.08 111.806 -178.917 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 46.7 m-20 -95.91 -14.78 22.86 Favored 'General case' 0 N--CA 1.506 2.372 0 O-C-N 120.408 -1.433 . . . . 1.07 108.236 178.982 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.617 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.98 38.9 4.09 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.601 -1.259 . . . . 0.14 107.601 179.263 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.4 pt20 -59.84 -26.58 65.92 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 109.414 -0.587 . . . . 1.47 109.414 -178.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.461 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 1.8 p30 -64.12 -36.29 83.56 Favored 'General case' 0 C--N 1.303 -1.422 0 O-C-N 120.804 -1.185 . . . . 1.05 109.495 179.24 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.461 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.2 t -73.26 -43.12 57.56 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 O-C-N 120.961 -1.087 . . . . 0.35 109.694 -179.895 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.9 -37.83 67.13 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.379 -0.826 . . . . 0.26 110.394 -178.677 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 84.8 p -60.99 -33.91 73.98 Favored 'General case' 0 C--N 1.302 -1.479 0 O-C-N 121.09 -1.007 . . . . 0.24 108.467 -179.895 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.1 tt0 -60.64 -40.02 90.41 Favored 'General case' 0 C--N 1.299 -1.61 0 O-C-N 121.538 -0.726 . . . . 2.06 109.056 179.278 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -90.18 4.58 50.09 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.331 -0.856 . . . . 0.23 110.869 -178.955 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.1 mp0 52.25 50.13 19.06 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 120.884 -1.135 . . . . 2.02 110.545 179.354 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.8 t -66.35 132.13 31.9 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.567 0 O-C-N 120.778 -1.201 . . . . 0.16 108.87 -179.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.1 mmtm -103.92 -9.89 18.58 Favored 'General case' 0 N--CA 1.486 1.347 0 O-C-N 121.719 -0.613 . . . . 1.6 109.611 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.516 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.45 155.79 20.33 Favored 'General case' 0 N--CA 1.496 1.832 0 O-C-N 120.772 -1.205 . . . . 0.14 111.772 179.955 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -126.04 154.3 73.98 Favored Pre-proline 0 N--CA 1.499 1.976 0 N-CA-C 107.566 -1.272 . . . . 0.15 107.566 178.212 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -78.86 140.06 56.93 Favored 'Cis proline' 0 N--CA 1.487 1.144 0 C-N-CA 123.657 -1.393 . . . . 0.16 111.97 -2.067 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.42 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.3 m -124.22 132.89 53.63 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.885 -0.783 . . . . 0.13 108.885 178.134 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.524 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.6 m-85 -110.67 131.48 55.01 Favored 'General case' 0 N--CA 1.492 1.647 0 N-CA-C 108.938 -0.764 . . . . 0.2 108.938 -179.581 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.9 mt-30 -121.63 140.4 52.31 Favored 'General case' 0 N--CA 1.499 1.981 0 N-CA-C 108.605 -0.887 . . . . 0.29 108.605 179.119 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.449 ' CD2' HG22 ' A' ' 24' ' ' VAL . 66.5 m-85 -107.87 131.15 54.8 Favored 'General case' 0 C--N 1.3 -1.586 0 CA-C-O 121.397 0.617 . . . . 0.14 109.679 -179.721 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 70.7 m-85 -125.62 148.98 48.78 Favored 'General case' 0 N--CA 1.488 1.455 0 N-CA-C 109.082 -0.71 . . . . 0.15 109.082 179.585 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 30.0 ttmt -147.31 127.74 14.03 Favored 'General case' 0 N--CA 1.493 1.68 0 N-CA-C 107.182 -1.414 . . . . 1.68 107.182 179.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.426 ' NZ ' ' CG ' ' A' ' 20' ' ' ASP . 40.4 mttm 56.09 33.26 21.62 Favored 'General case' 0 N--CA 1.494 1.727 0 O-C-N 121.057 -1.027 . . . . 1.22 108.89 -178.666 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 71.56 24.72 76.45 Favored Glycine 0 N--CA 1.484 1.883 0 N-CA-C 109.82 -1.312 . . . . 0.23 109.82 179.805 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.41 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.1 mm100 -129.23 135.92 49.43 Favored 'General case' 0 N--CA 1.503 2.204 0 O-C-N 121.513 -0.993 . . . . 2.07 110.809 179.943 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.8 ttpt -73.69 129.99 39.07 Favored 'General case' 0 N--CA 1.503 2.215 0 O-C-N 121.093 -1.004 . . . . 1.82 109.651 179.32 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.0 10.19 5.39 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.662 0 O-C-N 121.864 -0.523 . . . . 0.3 110.09 -179.732 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 164.01 161.78 13.77 Favored Glycine 0 N--CA 1.496 2.658 0 C-N-CA 118.373 -1.87 . . . . 0.17 112.051 179.605 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -165.25 154.65 12.65 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.872 -0.781 . . . . 1.93 109.325 179.5 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.45 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 5.8 p90 -166.92 157.03 11.38 Favored 'General case' 0 N--CA 1.49 1.567 0 C-N-CA 119.886 -0.726 . . . . 0.14 109.355 178.465 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.6 p -125.54 160.91 28.38 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 121.608 -0.682 . . . . 0.12 109.418 -179.319 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.461 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.7 143.34 6.11 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 108.532 -1.827 . . . . 0.12 108.532 -179.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -80.15 64.04 4.85 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.171 -1.193 . . . . 0.18 109.146 179.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.83 98.4 6.48 Favored 'General case' 0 N--CA 1.501 2.085 0 N-CA-C 108.336 -0.987 . . . . 0.88 108.336 179.108 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.44 -34.77 72.85 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.448 -0.782 . . . . 1.06 111.312 -179.922 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.4 mm-40 -62.57 -29.37 70.54 Favored 'General case' 0 N--CA 1.489 1.52 0 O-C-N 121.206 -0.934 . . . . 1.61 109.257 -179.728 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.2 tttt -60.9 -37.62 82.87 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 121.603 -0.686 . . . . 1.45 109.149 -179.182 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 74.8 mt -59.05 -39.79 83.11 Favored 'General case' 0 C--N 1.302 -1.465 0 N-CA-C 108.232 -1.025 . . . . 0.19 108.232 178.866 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 81.9 tt0 -60.37 -44.01 96.02 Favored 'General case' 0 N--CA 1.494 1.742 0 C-N-CA 120.051 -0.66 . . . . 2.1 110.503 -178.544 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -72.64 -44.08 62.37 Favored 'General case' 0 C--N 1.301 -1.531 0 O-C-N 120.966 -1.084 . . . . 0.19 111.318 -179.107 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.4 m -63.2 -40.03 96.34 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.644 -1.285 . . . . 0.2 109.739 -178.854 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 69.2 mt -62.1 -50.09 81.43 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.221 -0.924 . . . . 0.16 108.551 179.796 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.402 ' O ' HG12 ' A' ' 105' ' ' VAL . 21.9 t-20 -60.87 -34.35 74.48 Favored 'General case' 0 C--N 1.294 -1.822 0 CA-C-O 122.023 0.916 . . . . 0.95 108.758 179.194 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.2 tm-20 -67.61 -39.87 84.74 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.525 -0.734 . . . . 2.21 110.208 -178.43 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 75.8 mt -101.3 -3.13 29.46 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.019 -1.051 . . . . 0.25 111.493 -179.141 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.402 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.6 p . . . . . 0 N--CA 1.5 2.036 0 O-C-N 120.392 -1.442 . . . . 1.08 109.678 -179.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 24.9 Cg_endo . . . . . 0 N--CA 1.495 1.596 0 CA-C-O 121.212 0.421 . . . . 1.46 111.745 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.86 124.83 39.12 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.212 -0.93 . . . . 0.88 109.503 -179.947 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.408 ' O ' ' O ' ' B' ' 64' ' ' ILE . 24.0 m -111.18 129.91 55.8 Favored 'General case' 0 N--CA 1.499 2.018 0 N-CA-C 108.815 -0.809 . . . . 0.7 108.815 179.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.2 mt -65.75 -30.95 71.69 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 0.61 109.811 -179.553 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 41.3 mmtm -65.55 -16.6 63.85 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.438 -0.789 . . . . 1.31 109.541 -179.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.461 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.9 mm -130.0 140.78 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.316 0 N-CA-C 109.592 -0.521 . . . . 0.15 109.592 -179.622 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 16.9 m -101.61 129.49 47.74 Favored 'General case' 0 N--CA 1.505 2.29 0 N-CA-C 107.159 -1.423 . . . . 0.19 107.159 177.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.5 m -81.15 143.93 32.03 Favored 'General case' 0 N--CA 1.504 2.243 0 O-C-N 120.887 -1.133 . . . . 0.2 111.802 -178.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.516 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 27.6 m95 -76.79 -10.92 59.71 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.052 -1.03 . . . . 0.21 109.24 179.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -53.07 -10.96 0.21 Allowed 'General case' 0 N--CA 1.492 1.657 0 N-CA-C 108.625 -0.88 . . . . 0.49 108.625 179.821 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.448 ' H ' ' C ' ' B' ' 67' ' ' TRP . 31.0 m -64.34 141.59 18.0 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 O-C-N 121.38 -0.825 . . . . 1.04 109.377 179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 49.3 m-20 -59.38 -38.93 81.73 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.436 -0.79 . . . . 1.36 109.434 -179.738 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.187 0 CA-C-O 117.921 -1.488 . . . . 2.32 109.79 -179.847 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.472 ' C ' ' SD ' ' A' ' 1' ' ' MET . 1.4 tmt? . . . . . 0 N--CA 1.49 1.545 0 N-CA-C 108.963 -0.754 . . . . 2.88 108.963 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.466 HG21 ' ND1' ' A' ' 43' ' ' HIS . 90.5 t -101.41 154.67 4.76 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.011 0 O-C-N 121.372 -0.83 . . . . 0.45 109.747 -179.502 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.406 ' N ' HG12 ' A' ' 2' ' ' VAL . 21.5 ttpt -130.12 127.37 39.64 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.418 -0.956 . . . . 1.67 108.418 179.879 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 66.1 tt0 -94.91 125.31 39.49 Favored 'General case' 0 N--CA 1.495 1.825 0 O-C-N 121.166 -0.959 . . . . 0.31 109.265 -179.557 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.4 mm -100.56 116.36 43.84 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.674 0 N-CA-C 108.404 -0.961 . . . . 0.19 108.404 -179.878 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -99.64 -2.8 34.58 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.396 -0.815 . . . . 2.25 109.433 -179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -152.57 155.99 38.45 Favored 'General case' 0 N--CA 1.495 1.822 0 C-N-CA 119.257 -0.977 . . . . 0.15 111.189 179.617 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.8 ttmt -62.33 -33.81 75.42 Favored 'General case' 0 C--N 1.305 -1.36 0 N-CA-C 107.924 -1.139 . . . . 1.65 107.924 177.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 63.2 m -56.0 -49.39 73.77 Favored 'General case' 0 C--N 1.305 -1.369 0 C-N-CA 118.962 -1.095 . . . . 0.23 108.96 -178.807 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -67.72 -30.24 69.68 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.665 -0.865 . . . . 0.17 108.665 178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.55 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.1 t80 -59.77 -43.14 94.48 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.023 -1.048 . . . . 0.14 109.069 -179.989 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 90.9 mm-40 -65.49 -41.61 93.08 Favored 'General case' 0 C--N 1.3 -1.57 0 N-CA-C 108.33 -0.989 . . . . 1.31 108.33 179.914 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -66.57 -35.73 80.93 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.785 -0.572 . . . . 1.77 109.941 179.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.41 -41.33 80.6 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.23 -0.919 . . . . 0.15 108.746 -179.49 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.55 HD11 ' CE2' ' A' ' 11' ' ' PHE . 55.3 mt -61.37 -42.66 99.07 Favored 'General case' 0 C--N 1.303 -1.455 0 N-CA-C 108.419 -0.956 . . . . 0.17 108.419 179.248 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -68.49 -37.08 79.79 Favored 'General case' 0 N--CA 1.488 1.471 0 O-C-N 121.622 -0.674 . . . . 1.07 110.053 179.868 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.61 -38.63 84.22 Favored 'General case' 0 N--CA 1.488 1.444 0 O-C-N 121.336 -0.852 . . . . 0.18 109.64 -179.224 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -30.82 69.47 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.119 -0.988 . . . . 0.17 110.331 -179.872 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.77 -128.05 26.05 Favored Glycine 0 N--CA 1.493 2.5 0 N-CA-C 110.276 -1.13 . . . . 0.2 110.276 179.651 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -91.65 3.48 54.95 Favored 'General case' 0 N--CA 1.49 1.564 0 O-C-N 121.141 -1.211 . . . . 1.07 109.957 -179.155 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.4 mttp -75.16 149.16 39.09 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.022 -1.048 . . . . 1.5 109.44 -179.453 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.611 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.08 154.9 18.23 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 107.752 -1.203 . . . . 0.47 107.752 -179.637 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.611 ' H ' HD23 ' A' ' 22' ' ' LEU . 92.5 t -142.57 109.75 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 O-C-N 120.996 -1.065 . . . . 0.17 108.99 -179.602 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 27.3 t -100.12 141.16 17.64 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.723 0 N-CA-C 107.783 -1.191 . . . . 0.14 107.783 179.512 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.0 t -123.42 121.69 63.34 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.335 0 O-C-N 120.893 -1.13 . . . . 0.13 109.978 -178.826 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.563 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.55 121.72 40.85 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 121.359 -0.838 . . . . 1.05 110.11 179.218 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.4 m-85 -97.13 21.36 9.97 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.126 -0.984 . . . . 0.73 110.226 179.776 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.408 ' OG ' ' OD2' ' A' ' 26' ' ' ASP . 52.3 m -54.16 147.06 13.65 Favored 'General case' 0 C--N 1.294 -1.815 0 O-C-N 121.045 -1.034 . . . . 0.3 111.306 -178.627 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.559 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.94 126.19 33.3 Favored 'General case' 0 C--N 1.303 -1.418 0 N-CA-C 107.843 -1.169 . . . . 0.22 107.843 178.778 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.413 HG23 ' N ' ' A' ' 31' ' ' TRP . 7.8 t -66.93 -36.56 82.52 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.646 -1.284 . . . . 0.3 108.477 179.858 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.559 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.3 p-90 -69.9 -22.6 63.21 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.333 -0.854 . . . . 0.26 111.761 -179.772 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.9 t -83.77 118.39 23.88 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 120.715 -1.241 . . . . 0.26 108.806 -179.275 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.409 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.06 -54.39 37.14 Favored Glycine 0 N--CA 1.49 2.258 0 C-N-CA 120.1 -1.048 . . . . 0.23 111.074 -179.128 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.409 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 38.5 Cg_exo -50.69 -38.58 56.21 Favored 'Trans proline' 0 C--N 1.309 -1.549 0 CA-C-N 119.074 1.437 . . . . 0.31 111.95 179.981 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.72 -49.96 19.22 Favored 'General case' 0 N--CA 1.492 1.67 0 O-C-N 121.367 -0.833 . . . . 0.24 110.504 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.8 tttp -60.42 -38.12 83.06 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.091 -1.006 . . . . 1.59 109.391 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 22.5 ttt -57.42 -28.61 63.43 Favored 'General case' 0 C--N 1.299 -1.609 0 O-C-N 121.477 -0.765 . . . . 2.1 110.183 -179.206 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.56 HG22 ' O ' ' A' ' 38' ' ' ILE . 63.6 mt -85.18 -2.81 7.78 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.829 -0.544 . . . . 0.49 111.047 -179.328 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.572 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 3.4 ptmt -64.16 -29.54 3.99 Favored Pre-proline 0 N--CA 1.495 1.78 0 O-C-N 120.111 -1.618 . . . . 0.8 112.979 -178.592 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.572 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 37.0 Cg_exo -56.62 -41.67 73.4 Favored 'Trans proline' 0 N--CA 1.495 1.563 0 CA-C-N 121.525 1.581 . . . . 0.28 113.116 -176.877 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.536 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 31.3 m-85 -68.15 -44.7 75.43 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 120.249 -1.532 . . . . 0.37 108.575 179.789 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.5 t80 -61.14 -53.9 51.19 Favored 'General case' 0 C--N 1.303 -1.426 0 CA-C-O 121.79 0.805 . . . . 0.16 110.342 178.689 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.466 ' ND1' HG21 ' A' ' 2' ' ' VAL . 49.9 t60 -68.24 -42.27 79.97 Favored 'General case' 0 C--N 1.294 -1.83 0 O-C-N 121.77 -0.582 . . . . 0.32 111.404 -179.46 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.456 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 65.4 m -60.52 -37.76 82.2 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.102 -0.999 . . . . 0.22 110.692 -179.605 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 25.3 mt -63.15 -21.74 66.4 Favored 'General case' 0 N--CA 1.502 2.15 0 O-C-N 120.84 -1.163 . . . . 0.22 110.792 -178.373 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.0 m -51.56 -39.43 57.8 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.613 -1.304 . . . . 0.16 108.916 -178.521 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 74.4 mm-40 -82.46 -16.5 48.62 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.434 -0.791 . . . . 2.16 109.598 179.073 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 85.5 tttt -78.28 -36.68 46.35 Favored 'General case' 0 N--CA 1.488 1.465 0 N-CA-C 107.091 -1.448 . . . . 1.78 107.091 179.148 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 81.8 m-85 -124.18 67.85 1.06 Allowed 'General case' 0 N--CA 1.496 1.825 0 N-CA-C 107.353 -1.351 . . . . 0.25 107.353 177.306 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.2 p -63.86 -10.44 20.6 Favored 'General case' 0 C--N 1.307 -1.281 0 N-CA-C 108.574 -0.899 . . . . 0.22 108.574 179.891 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.9 t30 -89.25 6.16 41.55 Favored 'General case' 0 N--CA 1.491 1.591 0 N-CA-C 108.349 -0.982 . . . . 1.13 108.349 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.488 HG13 ' HB3' ' A' ' 22' ' ' LEU . 43.4 t -126.07 143.67 38.78 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.359 0 N-CA-C 107.289 -1.374 . . . . 0.24 107.289 179.439 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 32.6 mm -99.89 120.35 49.18 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.282 0 O-C-N 121.043 -1.036 . . . . 0.15 110.0 -178.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.41 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.0 m-85 -100.83 128.64 46.79 Favored 'General case' 0 N--CA 1.498 1.93 0 O-C-N 121.157 -0.965 . . . . 0.12 109.496 179.534 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.41 HD12 ' C ' ' A' ' 54' ' ' PHE . 2.8 mp -110.34 140.01 44.97 Favored 'General case' 0 N--CA 1.511 2.582 0 O-C-N 120.945 -1.097 . . . . 0.22 109.771 179.259 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -110.1 132.01 54.54 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 106.777 -1.564 . . . . 1.13 106.777 177.697 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.6 t -130.13 130.19 65.73 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.06 -1.025 . . . . 0.15 110.437 -178.213 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.554 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 47.6 t0 -93.0 121.07 33.96 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.27 -1.011 . . . . 1.05 108.27 179.444 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.3 m -68.37 -19.0 23.99 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.706 0 O-C-N 120.689 -1.257 . . . . 0.16 108.362 179.129 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.2 m-20 -92.66 -39.83 11.08 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.45 -0.781 . . . . 1.08 112.126 -179.183 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 49.8 m-20 -98.02 -14.39 20.57 Favored 'General case' 0 N--CA 1.507 2.419 0 O-C-N 120.708 -1.245 . . . . 1.07 108.199 179.221 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.554 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -126.83 39.32 3.94 Favored 'General case' 0 N--CA 1.493 1.72 0 N-CA-C 107.586 -1.264 . . . . 0.14 107.586 179.802 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.3 pt20 -59.79 -23.18 63.07 Favored 'General case' 0 C--N 1.295 -1.796 0 CA-C-N 115.748 -0.66 . . . . 1.47 110.097 -178.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.616 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -64.36 -39.99 94.97 Favored 'General case' 0 C--N 1.302 -1.476 0 O-C-N 120.94 -1.1 . . . . 1.05 109.177 179.619 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.616 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.1 t -69.54 -45.13 78.99 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.439 0 O-C-N 121.125 -0.985 . . . . 0.35 110.108 -179.7 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.03 -37.35 69.75 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.623 -0.673 . . . . 0.26 110.699 -178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.3 p -60.31 -39.43 86.95 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 120.936 -1.103 . . . . 0.24 109.981 -179.048 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 43.9 tp10 -62.88 -37.08 85.48 Favored 'General case' 0 N--CA 1.488 1.441 0 O-C-N 121.148 -0.97 . . . . 2.06 109.336 179.058 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.404 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.64 0.49 50.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 121.149 -0.97 . . . . 0.23 110.248 -179.618 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 52.28 50.25 18.79 Favored 'General case' 0 N--CA 1.494 1.75 0 O-C-N 120.868 -1.145 . . . . 2.02 109.375 179.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 35.3 t -64.17 134.57 28.87 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.675 0 O-C-N 120.46 -1.4 . . . . 0.16 108.138 -179.007 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.1 mmtt -106.51 -12.38 15.63 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.501 -0.749 . . . . 1.6 109.987 -178.587 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.523 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -161.49 155.02 21.54 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 120.96 -1.088 . . . . 0.14 110.378 179.682 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.62 155.72 80.8 Favored Pre-proline 0 N--CA 1.506 2.361 0 N-CA-C 107.596 -1.261 . . . . 0.15 107.596 178.539 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -73.03 142.87 76.08 Favored 'Cis proline' 0 N--CA 1.495 1.615 0 CA-C-N 120.22 1.114 . . . . 0.16 112.759 -2.321 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 89.8 m -130.1 129.97 44.24 Favored 'General case' 0 N--CA 1.495 1.819 0 N-CA-C 108.511 -0.922 . . . . 0.13 108.511 178.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.563 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 88.8 m-85 -106.94 130.32 54.62 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.4 -0.813 . . . . 0.2 109.741 -179.194 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.404 HE22 ' HB1' ' A' ' 69' ' ' ALA . 71.7 mt-30 -122.07 139.88 53.19 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.162 -0.961 . . . . 0.29 109.256 178.944 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.9 m-85 -105.82 137.76 43.15 Favored 'General case' 0 N--CA 1.492 1.65 0 CA-C-O 121.496 0.665 . . . . 0.14 110.448 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 78.9 m-85 -130.82 150.27 52.06 Favored 'General case' 0 N--CA 1.489 1.477 0 N-CA-C 108.82 -0.807 . . . . 0.15 108.82 179.041 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 18.7 tptm -147.16 129.37 15.64 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 107.562 -1.273 . . . . 1.68 107.562 -179.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 81.7 mttt 52.0 32.26 9.89 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.836 -1.165 . . . . 1.22 109.04 -178.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.83 21.65 76.15 Favored Glycine 0 N--CA 1.483 1.811 0 N-CA-C 110.452 -1.059 . . . . 0.23 110.452 178.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -127.87 142.48 51.26 Favored 'General case' 0 N--CA 1.502 2.152 0 O-C-N 121.298 -1.119 . . . . 2.07 110.26 179.845 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 62.4 tttm -76.84 127.34 32.56 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.46 -0.775 . . . . 1.82 109.456 179.616 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.7 m -121.35 1.56 6.79 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.041 0 O-C-N 121.562 -0.711 . . . . 0.3 110.442 179.723 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.92 163.69 31.02 Favored Glycine 0 N--CA 1.5 2.903 0 C-N-CA 118.701 -1.714 . . . . 0.17 111.57 -179.851 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.486 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.4 tp10 -166.7 149.97 6.88 Favored 'General case' 0 N--CA 1.5 2.054 0 O-C-N 121.53 -0.983 . . . . 1.93 109.178 179.756 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.486 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.6 p90 -168.76 157.72 8.56 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.084 -1.01 . . . . 0.14 109.794 177.338 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -126.76 164.51 21.18 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.602 -0.687 . . . . 0.12 109.736 -178.918 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.47 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 116.37 145.26 8.26 Favored Glycine 0 N--CA 1.492 2.38 0 N-CA-C 109.849 -1.301 . . . . 0.12 109.849 179.225 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.433 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -78.77 68.04 4.65 Favored 'General case' 0 C--N 1.303 -1.438 0 O-C-N 121.552 -0.97 . . . . 0.18 109.524 179.783 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.477 ' ND2' ' OE1' ' A' ' 95' ' ' GLU . 0.7 OUTLIER -119.15 91.69 3.62 Favored 'General case' 0 N--CA 1.502 2.171 0 N-CA-C 108.334 -0.988 . . . . 0.88 108.334 179.603 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.536 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.0 OUTLIER -67.27 -30.98 71.01 Favored 'General case' 0 N--CA 1.501 2.082 0 O-C-N 121.636 -0.665 . . . . 1.06 111.55 -178.841 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . 0.477 ' OE1' ' ND2' ' A' ' 93' ' ' ASN . 55.2 mp0 -67.42 -30.12 69.78 Favored 'General case' 0 C--N 1.304 -1.411 0 O-C-N 120.809 -1.182 . . . . 1.61 109.144 179.519 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -60.35 -35.26 75.25 Favored 'General case' 0 C--N 1.301 -1.511 0 O-C-N 121.268 -0.895 . . . . 1.45 108.762 -179.372 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 47.1 mt -59.56 -38.96 82.5 Favored 'General case' 0 C--N 1.302 -1.466 0 CA-C-O 121.904 0.859 . . . . 0.19 108.904 179.91 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 84.4 tt0 -62.83 -43.38 98.94 Favored 'General case' 0 C--N 1.294 -1.816 0 C-N-CA 119.997 -0.681 . . . . 2.1 111.043 -178.127 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.99 -43.8 70.7 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.114 -0.991 . . . . 0.19 112.032 -178.248 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.8 m -63.18 -39.5 94.83 Favored 'General case' 0 C--N 1.296 -1.749 0 O-C-N 120.943 -1.098 . . . . 0.2 109.996 -177.743 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.417 ' O ' ' N ' ' A' ' 105' ' ' VAL . 49.4 mt -62.89 -49.19 84.62 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.005 0 O-C-N 120.984 -1.073 . . . . 0.16 108.391 179.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.443 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.5 t-20 -59.86 -36.62 77.25 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.84 -1.17 . . . . 0.95 107.84 179.002 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -67.17 -39.54 86.47 Favored 'General case' 0 C--N 1.296 -1.722 0 O-C-N 121.62 -0.675 . . . . 2.21 109.718 -179.558 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.588 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.4 mt -100.82 0.57 38.91 Favored 'General case' 0 N--CA 1.502 2.144 0 O-C-N 120.839 -1.163 . . . . 0.25 111.683 -178.88 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.443 HG12 ' O ' ' A' ' 102' ' ' ASN . 7.9 p . . . . . 0 N--CA 1.497 1.892 0 O-C-N 120.191 -1.568 . . . . 1.08 109.395 -179.863 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 57.2 Cg_endo . . . . . 0 N--CA 1.491 1.346 0 CA-C-O 120.912 0.297 . . . . 1.46 112.632 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -92.24 119.59 31.99 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.867 -1.146 . . . . 0.88 109.965 -179.987 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.487 HG22 ' H ' ' B' ' 63' ' ' LYS . 28.6 m -115.68 130.03 56.7 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 108.898 -0.778 . . . . 0.7 108.898 179.414 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.8 mt -63.61 -30.67 71.75 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.27 -0.894 . . . . 0.61 109.74 -179.841 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.487 ' H ' HG22 ' B' ' 61' ' ' THR . 71.2 mmtt -62.49 -23.64 67.04 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.286 -0.884 . . . . 1.31 110.331 -179.454 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.523 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 31.2 mm -130.51 142.5 43.55 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.207 0 N-CA-C 109.728 -0.471 . . . . 0.15 109.728 -179.166 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.4 m -97.69 129.55 44.74 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 106.635 -1.617 . . . . 0.19 106.635 177.216 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -79.53 139.86 37.42 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.894 -1.129 . . . . 0.2 111.307 -177.858 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.505 ' O ' ' N ' ' B' ' 69' ' ' VAL . 24.0 m95 -74.42 -11.51 60.26 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.674 -0.641 . . . . 0.21 109.273 178.923 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.43 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.1 m120 -49.24 -13.16 0.06 Allowed 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.399 -0.813 . . . . 0.49 109.033 179.479 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.505 ' N ' ' O ' ' B' ' 67' ' ' TRP . 15.9 m -63.43 146.1 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.497 0 N-CA-C 108.373 -0.973 . . . . 1.04 108.373 178.733 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 27.0 m-20 -59.13 -40.43 85.45 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 120.763 -1.211 . . . . 1.36 109.345 -179.159 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.077 0 CA-C-O 117.929 -1.484 . . . . 2.32 109.468 -179.993 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 12.7 ptp . . . . . 0 N--CA 1.493 1.684 0 CA-C-O 121.356 0.598 . . . . 2.88 110.005 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.452 HG12 ' N ' ' A' ' 3' ' ' LYS . 98.9 t -99.43 158.6 3.65 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.107 0 O-C-N 121.285 -0.884 . . . . 0.45 109.868 -179.481 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.452 ' N ' HG12 ' A' ' 2' ' ' VAL . 43.9 tptt -130.06 129.56 43.78 Favored 'General case' 0 N--CA 1.5 2.074 0 N-CA-C 108.546 -0.909 . . . . 1.67 108.546 179.479 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.3 tt0 -96.45 124.01 40.3 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.201 -0.937 . . . . 0.31 108.653 179.352 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.2 mm -100.73 113.78 37.68 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.556 0 N-CA-C 108.364 -0.976 . . . . 0.19 108.364 179.442 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 96.0 mt-10 -99.74 -3.7 32.29 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.278 -0.889 . . . . 2.25 109.321 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.1 p -152.49 155.9 38.37 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.22 -0.925 . . . . 0.15 110.612 179.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 12.1 ttpp -64.59 -31.84 73.23 Favored 'General case' 0 C--N 1.304 -1.408 0 N-CA-C 108.349 -0.982 . . . . 1.65 108.349 178.642 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 61.7 m -55.64 -47.87 75.91 Favored 'General case' 0 N--CA 1.487 1.421 0 C-N-CA 119.416 -0.913 . . . . 0.23 109.018 179.92 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.08 -30.24 69.37 Favored 'General case' 0 N--CA 1.49 1.543 0 O-C-N 121.427 -0.796 . . . . 0.17 109.177 179.176 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.512 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.6 t80 -59.69 -45.23 92.73 Favored 'General case' 0 N--CA 1.489 1.515 0 O-C-N 121.189 -0.944 . . . . 0.14 109.237 -179.4 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 26.4 mm100 -63.87 -41.41 97.76 Favored 'General case' 0 C--N 1.299 -1.601 0 N-CA-C 108.89 -0.781 . . . . 1.31 108.89 179.694 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -64.98 -37.21 86.89 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 121.677 -0.639 . . . . 1.77 110.006 179.496 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.09 -42.45 80.32 Favored 'General case' 0 C--N 1.301 -1.506 0 O-C-N 121.369 -0.832 . . . . 0.15 109.42 -179.436 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.512 HD11 ' CE2' ' A' ' 11' ' ' PHE . 85.1 mt -60.21 -40.12 88.99 Favored 'General case' 0 C--N 1.302 -1.459 0 N-CA-C 108.444 -0.947 . . . . 0.17 108.444 -179.847 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.5 t70 -69.83 -34.77 74.1 Favored 'General case' 0 C--N 1.303 -1.447 0 O-C-N 121.625 -0.672 . . . . 1.07 109.925 179.428 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.13 -41.7 85.69 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.283 -0.886 . . . . 0.18 109.91 -179.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.47 -31.87 71.85 Favored 'General case' 0 N--CA 1.495 1.776 0 O-C-N 121.246 -0.909 . . . . 0.17 109.999 -179.931 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.49 18.38 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.687 -1.365 . . . . 0.2 109.687 -179.637 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 62.9 m-20 -91.77 2.52 56.45 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.327 -1.102 . . . . 1.07 110.374 -179.3 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 56.8 mttm -76.02 149.16 37.6 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 120.98 -1.075 . . . . 1.5 109.593 -179.689 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.666 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -59.84 159.57 8.81 Favored 'General case' 0 N--CA 1.487 1.378 0 N-CA-C 107.487 -1.301 . . . . 0.47 107.487 -179.681 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.666 ' H ' HD23 ' A' ' 22' ' ' LEU . 96.1 t -146.9 109.94 0.76 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.448 0 O-C-N 120.823 -1.173 . . . . 0.17 108.82 179.839 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 21.7 t -98.27 142.27 14.85 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.48 0 N-CA-C 107.971 -1.122 . . . . 0.14 107.971 179.71 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.4 t -124.96 121.0 60.03 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.455 -0.778 . . . . 0.13 109.488 -178.64 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.552 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.9 t70 -98.67 119.74 37.92 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.395 -0.816 . . . . 1.05 110.404 179.667 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.5 m-85 -96.18 21.67 8.61 Favored 'General case' 0 N--CA 1.502 2.138 0 O-C-N 121.456 -0.777 . . . . 0.73 109.743 179.283 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 53.2 m -57.29 145.01 33.47 Favored 'General case' 0 C--N 1.296 -1.735 0 O-C-N 120.978 -1.076 . . . . 0.3 109.945 -178.476 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.562 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.9 127.43 33.5 Favored 'General case' 0 C--N 1.304 -1.377 0 N-CA-C 107.678 -1.23 . . . . 0.22 107.678 179.155 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.1 t -68.59 -31.7 71.07 Favored 'General case' 0 C--N 1.298 -1.648 0 C-N-CA 118.827 -1.149 . . . . 0.3 108.822 -179.78 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.562 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.6 p-90 -73.22 -20.81 60.78 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 121.066 -1.021 . . . . 0.26 110.838 179.59 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.406 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 21.6 t -81.88 122.64 28.0 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 120.834 -1.166 . . . . 0.26 108.54 -179.333 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.491 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.42 -54.04 34.86 Favored Glycine 0 N--CA 1.489 2.175 0 C-N-CA 120.748 -0.739 . . . . 0.23 111.822 -178.439 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.491 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.2 Cg_endo -60.56 -30.0 89.71 Favored 'Trans proline' 0 C--N 1.315 -1.221 0 CA-C-N 119.398 1.599 . . . . 0.31 112.533 -179.638 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.406 ' HB3' ' HB3' ' A' ' 32' ' ' CYS . . . -77.39 -54.19 6.75 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.072 -1.017 . . . . 0.24 109.695 179.888 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 87.1 tttt -61.35 -38.15 85.91 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.305 -0.872 . . . . 1.59 109.673 179.851 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.44 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 35.5 ttm -59.88 -28.17 67.31 Favored 'General case' 0 N--CA 1.492 1.625 0 O-C-N 121.46 -0.775 . . . . 2.1 109.529 -179.047 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 38' ' ' ILE . 66.4 mt -80.94 -4.41 7.49 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 O-C-N 121.847 -0.533 . . . . 0.49 110.735 179.928 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.546 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.2 ptmt -64.36 -26.07 1.79 Allowed Pre-proline 0 N--CA 1.494 1.771 0 O-C-N 120.364 -1.46 . . . . 0.8 113.174 -178.081 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.546 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.5 Cg_exo -57.42 -40.29 82.47 Favored 'Trans proline' 0 N--CA 1.492 1.426 0 CA-C-N 122.468 1.917 . . . . 0.28 112.663 -177.1 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 38.9 m-85 -67.9 -46.16 72.38 Favored 'General case' 0 C--N 1.303 -1.431 0 C-N-CA 118.204 -1.398 . . . . 0.37 108.196 179.523 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.8 t80 -60.18 -53.9 52.23 Favored 'General case' 0 C--N 1.304 -1.406 0 O-C-N 121.125 -0.985 . . . . 0.16 109.884 179.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.404 ' ND1' HG21 ' A' ' 2' ' ' VAL . 38.0 t60 -68.09 -40.17 82.69 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.595 -0.691 . . . . 0.32 111.391 179.964 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.445 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.9 m -62.51 -39.16 92.62 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 120.855 -1.153 . . . . 0.22 110.643 -179.651 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.0 mt -61.86 -21.91 65.07 Favored 'General case' 0 N--CA 1.496 1.838 0 O-C-N 121.183 -0.948 . . . . 0.22 110.368 -178.554 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.3 m -53.51 -34.95 59.97 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 120.854 -1.154 . . . . 0.16 108.478 -179.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.476 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 44.8 mp0 -88.75 -14.9 36.05 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.486 -0.759 . . . . 2.16 109.123 179.595 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.2 tttt -79.13 -37.79 37.71 Favored 'General case' 0 N--CA 1.492 1.644 0 N-CA-C 107.708 -1.219 . . . . 1.78 107.708 178.874 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.5 m-85 -123.13 68.87 0.99 Allowed 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 106.861 -1.533 . . . . 0.25 106.861 178.291 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 59.8 p -63.38 -8.53 9.13 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.932 -0.766 . . . . 0.22 108.932 -179.271 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.4 t30 -90.98 8.94 32.74 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.275 -0.891 . . . . 1.13 108.62 179.022 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.448 HG13 ' HB3' ' A' ' 22' ' ' LEU . 42.8 t -127.29 144.97 35.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.685 -1.228 . . . . 0.24 107.685 178.849 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -99.82 123.65 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.034 0 O-C-N 121.009 -1.057 . . . . 0.15 109.473 -178.626 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.546 ' C ' HD12 ' A' ' 55' ' ' LEU . 44.3 m-85 -104.81 125.25 50.67 Favored 'General case' 0 N--CA 1.505 2.317 0 O-C-N 121.424 -0.798 . . . . 0.12 109.7 179.802 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.546 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.7 mp -110.0 142.7 41.03 Favored 'General case' 0 N--CA 1.503 2.205 0 O-C-N 121.121 -0.987 . . . . 0.22 109.196 179.277 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 76.8 tt0 -109.95 131.7 54.82 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 106.908 -1.516 . . . . 1.13 106.908 178.123 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.0 t -128.28 137.76 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.325 -0.859 . . . . 0.15 110.6 -178.19 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.41 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 58.0 t0 -100.17 119.0 37.66 Favored 'General case' 0 N--CA 1.496 1.858 0 N-CA-C 108.905 -0.776 . . . . 1.05 108.905 179.656 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -67.96 -17.54 22.49 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.601 0 O-C-N 120.394 -1.441 . . . . 0.16 108.149 179.157 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.513 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.3 m-20 -90.01 -42.72 10.99 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.332 -0.855 . . . . 1.08 111.458 -179.589 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 37.7 m-20 -97.66 -22.15 16.63 Favored 'General case' 0 N--CA 1.505 2.304 0 O-C-N 120.651 -1.28 . . . . 1.07 109.276 179.907 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.41 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -115.96 38.39 3.35 Favored 'General case' 0 N--CA 1.494 1.735 0 N-CA-C 107.146 -1.427 . . . . 0.14 107.146 179.127 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.65 HE21 ' H ' ' A' ' 64' ' ' ASP . 1.8 pm0 -60.34 -20.49 59.54 Favored 'General case' 0 C--N 1.301 -1.507 0 CA-C-N 115.814 -0.63 . . . . 1.47 109.65 -179.121 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.65 ' H ' HE21 ' A' ' 63' ' ' GLN . 1.5 p30 -63.76 -37.92 89.19 Favored 'General case' 0 C--N 1.304 -1.39 0 O-C-N 120.959 -1.088 . . . . 1.05 108.933 179.699 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.624 HG23 ' OD1' ' A' ' 64' ' ' ASP . 14.8 t -74.38 -43.55 49.36 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.482 0 O-C-N 121.327 -0.858 . . . . 0.35 109.532 179.593 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.26 -39.64 78.31 Favored 'General case' 0 N--CA 1.489 1.489 0 O-C-N 121.491 -0.755 . . . . 0.26 111.005 -178.466 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.9 p -62.64 -35.68 80.39 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.915 -1.116 . . . . 0.24 109.166 -179.579 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -63.6 -38.45 91.16 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.489 -0.757 . . . . 2.06 109.569 179.654 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.72 -0.19 56.57 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.282 -0.886 . . . . 0.23 111.285 -178.76 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 41.0 mp0 54.87 50.31 15.91 Favored 'General case' 0 N--CA 1.497 1.922 0 O-C-N 120.866 -1.146 . . . . 2.02 110.42 -179.909 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.9 t -65.66 132.24 31.34 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.547 0 O-C-N 120.941 -1.1 . . . . 0.16 109.114 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 43.4 mmtm -103.83 -11.94 17.22 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.601 -0.687 . . . . 1.6 110.693 -179.025 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.504 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -163.9 155.27 16.33 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 120.81 -1.181 . . . . 0.14 110.348 179.715 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -126.74 155.92 74.41 Favored Pre-proline 0 N--CA 1.498 1.959 0 N-CA-C 107.6 -1.259 . . . . 0.15 107.6 178.805 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -75.99 143.91 78.14 Favored 'Cis proline' 0 N--CA 1.487 1.098 0 C-N-CA 123.681 -1.383 . . . . 0.16 112.541 -1.709 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.1 m -128.82 133.79 48.13 Favored 'General case' 0 N--CA 1.49 1.568 0 N-CA-C 108.517 -0.92 . . . . 0.13 108.517 178.46 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.552 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -113.33 131.47 55.95 Favored 'General case' 0 C--N 1.298 -1.638 0 N-CA-C 108.538 -0.912 . . . . 0.2 108.538 -179.309 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.6 mt-30 -122.54 141.62 51.48 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.273 -0.892 . . . . 0.29 108.684 179.723 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 65.9 m-85 -107.8 132.64 53.19 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.697 -0.627 . . . . 0.14 110.582 -178.796 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.5 m-85 -125.28 147.39 49.13 Favored 'General case' 0 N--CA 1.495 1.815 0 CA-C-O 121.368 0.604 . . . . 0.15 109.499 179.54 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 36.7 ttmt -148.36 124.33 10.66 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.305 -0.872 . . . . 1.68 109.025 -179.632 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.8 mttm 59.63 29.08 18.63 Favored 'General case' 0 N--CA 1.495 1.784 0 N-CA-C 107.715 -1.217 . . . . 1.22 107.715 -178.976 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.24 20.58 77.1 Favored Glycine 0 N--CA 1.486 1.976 0 N-CA-C 109.593 -1.403 . . . . 0.23 109.593 -179.132 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 3.6 mm100 -124.21 137.02 54.57 Favored 'General case' 0 N--CA 1.505 2.276 0 O-C-N 121.483 -1.01 . . . . 2.07 110.965 -179.85 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.6 tttt -78.64 125.42 29.34 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 121.1 -1.0 . . . . 1.82 108.851 178.985 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.9 m -124.62 13.89 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.902 0 O-C-N 121.724 -0.61 . . . . 0.3 110.703 -179.387 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.45 157.55 18.63 Favored Glycine 0 N--CA 1.499 2.88 0 C-N-CA 118.969 -1.586 . . . . 0.17 111.066 179.522 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.482 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.92 148.44 7.33 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.553 -0.906 . . . . 1.93 108.553 179.293 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.482 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 3.5 p90 -168.23 157.59 9.43 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.241 -0.912 . . . . 0.14 109.749 178.103 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.7 p -126.52 159.88 32.16 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 121.529 -0.732 . . . . 0.12 110.041 -179.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.46 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.95 143.7 6.62 Favored Glycine 0 N--CA 1.494 2.553 0 N-CA-C 109.805 -1.318 . . . . 0.12 109.805 178.969 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.499 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.91 64.76 3.2 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.19 -1.182 . . . . 0.18 109.81 -179.932 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.42 94.25 4.48 Favored 'General case' 0 N--CA 1.498 1.962 0 N-CA-C 108.015 -1.106 . . . . 0.88 108.015 178.617 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.11 -31.44 71.04 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.04 -1.037 . . . . 1.06 111.129 -179.389 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -65.3 -29.77 70.56 Favored 'General case' 0 N--CA 1.487 1.403 0 O-C-N 120.905 -1.122 . . . . 1.61 109.351 -179.629 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.8 tttt -60.42 -34.31 73.78 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 108.916 -0.772 . . . . 1.45 108.916 -179.185 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 77.0 mt -59.67 -38.81 82.5 Favored 'General case' 0 C--N 1.302 -1.479 0 CA-C-O 122.051 0.929 . . . . 0.19 108.74 179.008 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.4 tp10 -62.2 -43.72 98.2 Favored 'General case' 0 C--N 1.292 -1.918 0 C-N-CA 119.785 -0.766 . . . . 2.1 110.909 -178.07 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.78 -44.0 74.56 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 121.129 -0.982 . . . . 0.19 111.861 -178.337 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.4 m -64.79 -40.06 94.62 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 120.741 -1.224 . . . . 0.2 109.64 -178.841 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 61.6 mt -60.79 -49.58 83.98 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.758 0 N-CA-C 108.339 -0.986 . . . . 0.16 108.339 178.822 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.483 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.6 t-20 -60.35 -35.18 75.08 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.99 0.9 . . . . 0.95 108.581 178.728 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.2 tm-20 -66.81 -39.58 87.75 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.864 -0.523 . . . . 2.21 109.6 -178.608 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.662 ' HB2' HD11 ' A' ' 22' ' ' LEU . 82.5 mt -99.63 -2.86 34.47 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 121.197 -0.94 . . . . 0.25 111.631 -179.133 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.483 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.496 1.842 0 O-C-N 120.545 -1.347 . . . . 1.08 109.515 -179.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 77.0 Cg_exo . . . . . 0 N--CA 1.493 1.456 0 CA-C-O 121.297 0.457 . . . . 1.46 112.31 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -91.64 121.39 33.26 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.199 -0.938 . . . . 0.88 108.907 179.799 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.453 HG22 ' H ' ' B' ' 63' ' ' LYS . 23.7 m -106.91 129.88 54.67 Favored 'General case' 0 N--CA 1.502 2.141 0 O-C-N 121.308 -0.87 . . . . 0.7 109.371 -179.606 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 90.5 mt -62.97 -29.89 71.16 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.472 -0.768 . . . . 0.61 109.756 -179.856 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.453 ' H ' HG22 ' B' ' 61' ' ' THR . 45.3 mmtm -60.03 -19.68 53.99 Favored 'General case' 0 N--CA 1.49 1.572 0 N-CA-C 108.815 -0.809 . . . . 1.31 108.815 -179.302 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.504 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 28.5 mm -131.5 140.0 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.274 0 O-C-N 121.864 -0.522 . . . . 0.15 109.732 179.916 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.0 m -96.4 128.44 43.33 Favored 'General case' 0 N--CA 1.499 1.986 0 N-CA-C 107.156 -1.424 . . . . 0.19 107.156 177.374 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 55.2 m -77.61 141.6 39.4 Favored 'General case' 0 N--CA 1.494 1.775 0 O-C-N 120.723 -1.235 . . . . 0.2 110.751 -178.705 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.459 ' C ' ' H ' ' B' ' 69' ' ' VAL . 25.7 m95 -76.94 -11.83 59.86 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.439 -0.788 . . . . 0.21 108.912 178.89 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.5 m120 -52.94 -11.09 0.2 Allowed 'General case' 0 C--N 1.304 -1.398 0 N-CA-C 108.586 -0.894 . . . . 0.49 108.586 179.514 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.459 ' H ' ' C ' ' B' ' 67' ' ' TRP . 15.6 m -61.8 140.45 19.1 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 119.639 -0.824 . . . . 1.04 109.133 179.831 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 62.7 m-20 -60.15 -39.7 87.26 Favored 'General case' 0 N--CA 1.489 1.517 0 O-C-N 121.266 -0.896 . . . . 1.36 109.741 -179.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.101 0 N-CA-C 108.927 -1.669 . . . . 2.32 108.927 -179.364 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.1 mmt . . . . . 0 N--CA 1.491 1.597 0 N-CA-C 109.055 -0.721 . . . . 2.88 109.055 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 73.0 t -98.42 137.57 25.56 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.982 0 O-C-N 121.386 -0.821 . . . . 0.45 109.235 179.775 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 41.0 tptt -130.61 128.96 42.08 Favored 'General case' 0 N--CA 1.499 1.983 0 O-C-N 121.256 -0.902 . . . . 1.67 108.874 -179.77 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -97.86 121.88 40.31 Favored 'General case' 0 N--CA 1.497 1.9 0 N-CA-C 108.235 -1.024 . . . . 0.31 108.235 179.068 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.0 mm -99.99 112.89 33.81 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.67 0 O-C-N 121.257 -0.902 . . . . 0.19 108.743 179.721 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -97.04 -0.03 47.91 Favored 'General case' 0 N--CA 1.491 1.619 0 O-C-N 121.249 -0.907 . . . . 2.25 109.903 -179.854 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -153.53 156.39 37.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.707 -1.246 . . . . 0.15 110.839 179.992 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 34.7 ttmt -65.06 -33.0 74.99 Favored 'General case' 0 N--CA 1.487 1.401 0 N-CA-C 108.318 -0.993 . . . . 1.65 108.318 178.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 90.0 m -56.14 -48.05 76.99 Favored 'General case' 0 C--N 1.304 -1.391 0 N-CA-C 108.871 -0.788 . . . . 0.23 108.871 -179.079 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.67 -29.69 66.08 Favored 'General case' 0 C--N 1.295 -1.763 0 O-C-N 121.545 -0.722 . . . . 0.17 109.089 178.996 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.535 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.9 t80 -59.66 -44.09 93.7 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.188 -0.945 . . . . 0.14 109.164 -179.707 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 24.1 mm100 -65.92 -43.93 86.65 Favored 'General case' 0 C--N 1.296 -1.752 0 N-CA-C 108.834 -0.802 . . . . 1.31 108.834 179.979 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -63.59 -36.31 83.38 Favored 'General case' 0 N--CA 1.492 1.639 0 CA-C-O 121.465 0.65 . . . . 1.77 110.068 179.658 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.97 -43.84 78.08 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 121.349 -0.845 . . . . 0.15 109.439 -179.506 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.535 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.6 mt -60.88 -40.14 91.89 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 121.441 -0.787 . . . . 0.17 109.321 -179.994 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 50.7 t0 -69.48 -32.61 71.61 Favored 'General case' 0 N--CA 1.488 1.46 0 O-C-N 121.426 -0.796 . . . . 1.07 110.448 -179.706 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.03 -39.68 83.04 Favored 'General case' 0 N--CA 1.49 1.563 0 O-C-N 121.198 -0.939 . . . . 0.18 109.355 -179.147 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.82 -36.11 80.18 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.511 -0.743 . . . . 0.17 109.625 179.803 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.48 -123.27 16.29 Favored Glycine 0 N--CA 1.491 2.315 0 N-CA-C 109.976 -1.249 . . . . 0.2 109.976 -179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.4 m-20 -91.15 3.75 53.98 Favored 'General case' 0 N--CA 1.497 1.9 0 O-C-N 121.195 -1.18 . . . . 1.07 110.224 -179.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 43.1 mtpt -77.14 149.18 35.65 Favored 'General case' 0 N--CA 1.492 1.633 0 O-C-N 120.994 -1.066 . . . . 1.5 109.768 -179.395 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.694 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.3 153.72 21.88 Favored 'General case' 0 C--N 1.306 -1.301 0 N-CA-C 107.834 -1.173 . . . . 0.47 107.834 -179.798 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.694 ' H ' HD23 ' A' ' 22' ' ' LEU . 57.3 t -143.97 120.73 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.432 0 N-CA-C 107.995 -1.113 . . . . 0.17 107.995 179.546 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.5 t -108.03 140.08 27.8 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 N-CA-C 108.456 -0.942 . . . . 0.14 108.456 179.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.6 t -123.25 119.9 58.84 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.025 0 O-C-N 121.327 -0.858 . . . . 0.13 109.462 -179.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.568 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 25.6 t70 -97.37 108.96 21.79 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.496 -0.753 . . . . 1.05 110.8 179.96 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -89.98 103.03 15.73 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 106.268 -1.753 . . . . 0.73 106.268 177.121 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 62.4 m -130.07 150.05 51.51 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 109.016 -0.735 . . . . 0.3 109.016 -179.58 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.625 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -87.61 120.97 29.46 Favored 'General case' 0 C--N 1.298 -1.637 0 N-CA-C 107.455 -1.313 . . . . 0.22 107.455 178.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -65.73 -32.21 73.63 Favored 'General case' 0 C--N 1.299 -1.606 0 C-N-CA 118.541 -1.264 . . . . 0.3 108.039 179.911 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.625 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.3 p-90 -70.73 -23.77 62.51 Favored 'General case' 0 N--CA 1.499 1.986 0 O-C-N 121.32 -0.863 . . . . 0.26 111.063 179.256 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.5 t -84.43 115.13 22.38 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 120.827 -1.171 . . . . 0.26 108.751 -179.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.454 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.72 -50.75 64.3 Favored Glycine 0 N--CA 1.492 2.433 0 C-N-CA 120.819 -0.705 . . . . 0.23 111.787 -178.272 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.454 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.2 Cg_exo -51.97 -36.18 63.55 Favored 'Trans proline' 0 C--N 1.311 -1.44 0 CA-C-N 118.826 1.313 . . . . 0.31 112.866 -179.414 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.5 -47.83 21.53 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.128 -0.982 . . . . 0.24 109.623 179.863 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 34.7 ttpt -60.28 -35.68 76.1 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.276 -0.89 . . . . 1.59 109.097 179.438 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.54 ' SD ' ' O ' ' A' ' 37' ' ' MET . 11.6 tmm? -59.64 -29.36 67.98 Favored 'General case' 0 N--CA 1.493 1.692 0 O-C-N 121.516 -0.74 . . . . 2.1 110.06 -179.696 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.539 HG22 ' O ' ' A' ' 38' ' ' ILE . 71.0 mt -82.71 -1.32 5.55 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.539 -0.726 . . . . 0.49 110.822 -178.545 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.538 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.96 -30.12 6.43 Favored Pre-proline 0 N--CA 1.494 1.751 0 O-C-N 120.535 -1.353 . . . . 0.8 113.976 -178.832 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.538 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.38 -40.6 66.08 Favored 'Trans proline' 0 N--CA 1.495 1.603 0 CA-C-N 121.618 1.614 . . . . 0.28 113.266 -177.918 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 42.9 m-85 -68.8 -49.66 56.73 Favored 'General case' 0 C--N 1.303 -1.442 0 C-N-CA 118.365 -1.334 . . . . 0.37 109.303 -179.989 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.8 t80 -60.33 -51.08 71.06 Favored 'General case' 0 C--N 1.301 -1.518 0 CA-C-O 121.761 0.791 . . . . 0.16 109.34 179.25 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.7 t60 -66.73 -40.96 88.58 Favored 'General case' 0 N--CA 1.489 1.506 0 O-C-N 121.621 -0.674 . . . . 0.32 110.724 -179.919 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.422 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 72.3 m -63.39 -39.02 93.37 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.903 -1.123 . . . . 0.22 110.498 -179.709 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 28.6 mt -62.34 -23.08 66.57 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 0.22 111.366 -178.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 62.4 m -56.27 -36.09 68.19 Favored 'General case' 0 C--N 1.299 -1.589 0 O-C-N 120.788 -1.195 . . . . 0.16 108.364 -179.365 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 71.5 mm-40 -88.94 -15.56 33.99 Favored 'General case' 0 N--CA 1.489 1.501 0 O-C-N 121.273 -0.892 . . . . 2.16 109.355 178.752 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HD3' ' CE2' ' A' ' 49' ' ' TYR . 13.2 tmtt? -79.26 -33.81 43.17 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 107.151 -1.425 . . . . 1.78 107.151 179.417 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.411 ' CE2' ' HD3' ' A' ' 48' ' ' LYS . 71.3 m-85 -122.16 64.43 0.93 Allowed 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 106.776 -1.564 . . . . 0.25 106.776 177.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.5 p -61.86 -9.29 6.4 Favored 'General case' 0 C--N 1.303 -1.436 0 N-CA-C 108.74 -0.837 . . . . 0.22 108.74 -179.27 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 28.7 t30 -91.1 8.63 34.6 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.506 -0.746 . . . . 1.13 109.207 179.723 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.0 t -128.24 152.72 36.74 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.763 0 N-CA-C 108.225 -1.028 . . . . 0.24 108.225 178.883 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -102.73 122.12 54.69 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.128 0 O-C-N 121.148 -0.97 . . . . 0.15 110.132 -179.044 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.589 ' C ' HD12 ' A' ' 55' ' ' LEU . 54.0 m-85 -105.49 130.05 53.65 Favored 'General case' 0 N--CA 1.506 2.338 0 O-C-N 121.238 -0.914 . . . . 0.12 109.868 179.445 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.589 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.4 mp -114.29 143.14 45.36 Favored 'General case' 0 N--CA 1.505 2.289 0 O-C-N 121.307 -0.871 . . . . 0.22 109.495 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -113.66 131.08 56.28 Favored 'General case' 0 N--CA 1.493 1.701 0 N-CA-C 106.954 -1.499 . . . . 1.13 106.954 178.004 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 51.4 t -128.43 136.46 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.221 0 O-C-N 121.215 -0.928 . . . . 0.15 111.344 -177.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.439 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.4 t0 -99.49 120.01 38.94 Favored 'General case' 0 N--CA 1.496 1.866 0 N-CA-C 108.932 -0.766 . . . . 1.05 108.932 178.94 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.7 m -68.25 -16.7 21.34 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.715 0 O-C-N 120.523 -1.361 . . . . 0.16 108.471 179.037 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.409 ' OD1' ' CD1' ' A' ' 31' ' ' TRP . 2.6 m-20 -94.47 -40.76 9.72 Favored 'General case' 0 N--CA 1.493 1.686 0 O-C-N 121.426 -0.796 . . . . 1.08 111.448 -179.114 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 76.5 m-20 -96.84 -16.79 20.59 Favored 'General case' 0 N--CA 1.506 2.36 0 O-C-N 120.796 -1.19 . . . . 1.07 108.62 179.494 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.439 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.61 40.67 3.67 Favored 'General case' 0 N--CA 1.497 1.887 0 N-CA-C 107.489 -1.3 . . . . 0.14 107.489 179.0 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 13.5 pt20 -60.09 -20.31 57.51 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.879 -0.513 . . . . 1.47 110.206 -178.513 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.644 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.7 p30 -65.56 -38.65 90.17 Favored 'General case' 0 N--CA 1.488 1.453 0 O-C-N 120.683 -1.26 . . . . 1.05 109.176 179.318 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.644 HG23 ' OD1' ' A' ' 64' ' ' ASP . 20.1 t -72.76 -42.57 61.7 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.199 -0.938 . . . . 0.35 109.459 -179.915 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.71 -41.95 71.25 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.484 -0.76 . . . . 0.26 110.999 -178.81 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.7 p -60.14 -36.08 76.72 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.869 -1.144 . . . . 0.24 108.533 -179.52 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 48.8 tt0 -64.41 -39.28 93.54 Favored 'General case' 0 C--N 1.3 -1.556 0 O-C-N 121.475 -0.766 . . . . 2.06 109.492 179.131 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.56 0.45 54.32 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.25 -0.906 . . . . 0.23 111.019 -178.86 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.8 mp0 54.14 50.07 17.33 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 120.917 -1.115 . . . . 2.02 110.059 179.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -65.58 131.69 31.33 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.522 0 O-C-N 120.787 -1.196 . . . . 0.16 109.043 -179.048 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.5 mmtt -103.71 -14.36 16.13 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.717 -0.614 . . . . 1.6 109.937 -178.973 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.461 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.6 152.33 15.94 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 120.938 -1.101 . . . . 0.14 110.769 179.586 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.407 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.4 p -127.49 154.4 77.44 Favored Pre-proline 0 N--CA 1.503 2.176 0 N-CA-C 107.736 -1.209 . . . . 0.15 107.736 179.022 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.8 Cg_endo -76.22 141.19 69.57 Favored 'Cis proline' 0 N--CA 1.495 1.59 0 C-N-CA 124.147 -1.189 . . . . 0.16 112.991 -1.889 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.461 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.2 m -126.72 139.2 53.32 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.498 -0.927 . . . . 0.13 108.498 177.845 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.568 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.8 m-85 -112.61 131.8 55.45 Favored 'General case' 0 N--CA 1.493 1.681 0 N-CA-C 108.349 -0.982 . . . . 0.2 108.349 -179.773 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.98 139.9 53.59 Favored 'General case' 0 N--CA 1.495 1.783 0 N-CA-C 108.432 -0.951 . . . . 0.29 108.432 179.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.9 m-85 -107.68 129.6 55.0 Favored 'General case' 0 N--CA 1.492 1.643 0 CA-C-O 121.542 0.687 . . . . 0.14 110.034 -179.281 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.7 m-85 -122.58 143.27 49.85 Favored 'General case' 0 N--CA 1.487 1.411 0 N-CA-C 108.753 -0.832 . . . . 0.15 108.753 179.391 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 54.6 tttm -146.28 130.61 17.61 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 106.426 -1.694 . . . . 1.68 106.426 179.181 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.2 mttt 58.17 27.75 15.52 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 108.449 -0.945 . . . . 1.22 108.449 -178.099 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.3 17.26 80.1 Favored Glycine 0 N--CA 1.488 2.111 0 N-CA-C 109.893 -1.283 . . . . 0.23 109.893 -179.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.3 mm100 -123.33 138.48 54.6 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.449 -1.03 . . . . 2.07 111.107 -179.346 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 25.7 ttpp -79.58 124.44 28.53 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.352 -0.842 . . . . 1.82 109.347 179.192 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 22.2 m -121.53 6.81 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.995 0 O-C-N 121.529 -0.732 . . . . 0.3 110.648 -179.787 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.34 155.56 15.31 Favored Glycine 0 N--CA 1.495 2.628 0 C-N-CA 118.666 -1.731 . . . . 0.17 111.321 179.885 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 64.4 tt0 -164.25 149.89 10.61 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.812 -0.816 . . . . 1.93 109.546 179.465 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.407 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 17.8 p90 -163.01 161.81 25.65 Favored 'General case' 0 N--CA 1.492 1.669 0 C-N-CA 118.92 -1.112 . . . . 0.14 109.151 177.186 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -127.0 162.38 26.14 Favored 'General case' 0 N--CA 1.497 1.895 0 CA-C-O 121.485 0.66 . . . . 0.12 110.276 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.494 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 118.27 141.66 6.78 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.465 -1.454 . . . . 0.12 109.465 179.393 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.01 64.88 1.97 Allowed 'General case' 0 C--N 1.3 -1.565 0 O-C-N 121.34 -1.094 . . . . 0.18 109.795 -179.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -117.47 95.9 5.17 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 108.558 -0.904 . . . . 0.88 108.558 178.796 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.86 -34.1 73.15 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.248 -0.908 . . . . 1.06 111.212 -179.529 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -62.24 -30.1 70.87 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 120.806 -1.184 . . . . 1.61 108.783 -179.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.9 tttt -61.98 -34.43 76.14 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.746 -0.596 . . . . 1.45 109.404 -179.568 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.417 HD21 ' CD1' ' A' ' 77' ' ' PHE . 50.8 mt -59.87 -39.93 86.93 Favored 'General case' 0 N--CA 1.488 1.441 0 CA-C-O 122.13 0.967 . . . . 0.19 108.888 179.477 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.9 tm-20 -61.65 -43.64 98.48 Favored 'General case' 0 C--N 1.293 -1.883 0 C-N-CA 119.922 -0.711 . . . . 2.1 110.581 -177.882 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.29 -44.09 76.25 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.282 -0.886 . . . . 0.19 111.629 -178.682 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.4 -40.02 92.91 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.733 -1.229 . . . . 0.2 109.659 -178.645 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 73.6 mt -60.94 -49.48 84.52 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.797 0 N-CA-C 108.206 -1.035 . . . . 0.16 108.206 178.826 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.465 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.5 t-20 -60.12 -34.78 73.98 Favored 'General case' 0 C--N 1.302 -1.46 0 N-CA-C 108.48 -0.933 . . . . 0.95 108.48 179.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -67.91 -40.05 83.48 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.688 -0.632 . . . . 2.21 110.325 -178.643 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.643 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.9 mt -98.77 -3.68 35.09 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.148 -0.97 . . . . 0.25 111.117 -179.221 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.465 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.492 1.631 0 O-C-N 120.548 -1.345 . . . . 1.08 109.076 -179.036 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_exo . . . . . 0 N--CA 1.494 1.536 0 CA-C-O 121.366 0.486 . . . . 1.46 111.632 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -104.77 122.59 46.03 Favored 'General case' 0 N--CA 1.493 1.724 0 N-CA-C 108.699 -0.852 . . . . 0.88 108.699 179.479 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.446 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.9 m -103.31 128.08 50.47 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.424 -0.797 . . . . 0.7 109.301 -179.617 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.1 mt -69.6 -26.53 64.49 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.365 -0.834 . . . . 0.61 109.401 179.659 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.446 ' H ' HG22 ' B' ' 61' ' ' THR . 63.4 mmtt -60.6 -19.68 58.45 Favored 'General case' 0 C--N 1.301 -1.535 0 O-C-N 121.626 -0.671 . . . . 1.31 109.416 -179.199 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.494 HD11 ' HA2' ' A' ' 91' ' ' GLY . 31.7 mm -129.17 140.07 50.18 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.544 0 O-C-N 121.622 -0.674 . . . . 0.15 109.967 179.97 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 63.3 m -96.75 124.35 40.71 Favored 'General case' 0 N--CA 1.498 1.935 0 N-CA-C 107.163 -1.421 . . . . 0.19 107.163 177.553 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.4 m -77.61 141.57 39.41 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.845 -1.159 . . . . 0.2 110.908 -178.608 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.446 ' C ' ' N ' ' B' ' 69' ' ' VAL . 20.2 m95 -76.56 -10.01 59.08 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.005 -1.059 . . . . 0.21 108.508 178.565 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -53.43 -11.76 0.36 Allowed 'General case' 0 C--N 1.304 -1.383 0 N-CA-C 108.577 -0.897 . . . . 0.49 108.577 179.847 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.446 ' N ' ' C ' ' B' ' 67' ' ' TRP . 16.5 m -61.32 144.46 13.82 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.52 0 O-C-N 121.38 -0.825 . . . . 1.04 109.114 179.633 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 67.1 m-20 -59.03 -40.03 83.78 Favored 'General case' 0 N--CA 1.49 1.549 0 O-C-N 121.16 -0.962 . . . . 1.36 109.247 -179.518 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.243 0 N-CA-C 109.446 -1.461 . . . . 2.32 109.446 179.931 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.4 mmt . . . . . 0 N--CA 1.492 1.67 0 N-CA-C 109.306 -0.627 . . . . 2.88 109.306 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 93.5 t -99.2 131.6 46.17 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.036 0 O-C-N 121.205 -0.934 . . . . 0.45 108.605 179.725 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.8 tptt -130.02 129.18 43.37 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.269 -1.011 . . . . 1.67 108.269 -179.203 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -98.01 123.7 42.14 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.331 -0.989 . . . . 0.31 108.331 179.509 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 32.0 mm -101.56 112.79 35.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.766 0 O-C-N 121.186 -0.946 . . . . 0.19 108.508 179.495 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.444 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 50.4 mp0 -95.87 -1.26 49.78 Favored 'General case' 0 N--CA 1.486 1.331 0 O-C-N 121.313 -0.867 . . . . 2.25 109.392 -179.057 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -153.98 154.8 34.41 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 120.947 -1.096 . . . . 0.15 111.439 179.556 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.412 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 11.9 ttpp -63.38 -31.16 72.24 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 107.98 -1.119 . . . . 1.65 107.98 177.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 77.8 m -59.05 -46.65 87.7 Favored 'General case' 0 N--CA 1.489 1.484 0 N-CA-C 108.934 -0.765 . . . . 0.23 108.934 -179.753 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.76 -30.02 66.4 Favored 'General case' 0 C--N 1.295 -1.764 0 O-C-N 121.288 -0.883 . . . . 0.17 108.692 178.38 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.58 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.6 t80 -59.45 -43.83 93.08 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.119 -0.988 . . . . 0.14 109.321 -179.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -63.68 -41.98 98.09 Favored 'General case' 0 C--N 1.297 -1.703 0 C-N-CA 119.634 -0.827 . . . . 1.31 108.796 179.942 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 87.0 mt-10 -64.94 -39.87 94.17 Favored 'General case' 0 N--CA 1.494 1.761 0 O-C-N 121.666 -0.646 . . . . 1.77 110.483 179.928 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.28 -41.24 94.37 Favored 'General case' 0 N--CA 1.488 1.431 0 O-C-N 121.308 -0.87 . . . . 0.15 108.966 -179.517 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.58 HD11 ' CE2' ' A' ' 11' ' ' PHE . 39.6 mt -61.23 -40.17 93.01 Favored 'General case' 0 C--N 1.303 -1.431 0 O-C-N 121.112 -0.993 . . . . 0.17 108.734 179.463 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 44.7 t0 -70.28 -34.55 72.91 Favored 'General case' 0 C--N 1.302 -1.483 0 C-N-CA 119.965 -0.694 . . . . 1.07 109.698 179.819 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.45 -41.03 80.82 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 121.362 -0.836 . . . . 0.18 110.298 -178.69 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.89 -30.23 70.73 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 121.069 -1.02 . . . . 0.17 109.41 -179.952 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.81 -124.57 21.07 Favored Glycine 0 N--CA 1.488 2.132 0 N-CA-C 109.144 -1.582 . . . . 0.2 109.144 -179.663 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -91.97 0.46 57.47 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 121.355 -1.085 . . . . 1.07 110.336 -179.435 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.2 mtpt -75.72 149.89 37.96 Favored 'General case' 0 N--CA 1.492 1.629 0 O-C-N 120.996 -1.065 . . . . 1.5 109.345 -179.23 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.431 HD23 ' HA ' ' A' ' 22' ' ' LEU . 11.1 mt -55.81 160.58 2.58 Favored 'General case' 0 N--CA 1.492 1.645 0 O-C-N 121.019 -1.051 . . . . 0.47 110.213 -179.866 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 92.1 t -148.62 108.35 0.54 Allowed 'Isoleucine or valine' 0 C--N 1.306 -1.311 0 N-CA-C 107.995 -1.113 . . . . 0.17 107.995 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 47.3 t -100.95 140.8 18.9 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.591 0 N-CA-C 107.606 -1.257 . . . . 0.14 107.606 179.551 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.7 t -124.63 124.5 68.27 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 121.186 -0.946 . . . . 0.13 109.748 -178.553 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 66.1 t0 -101.09 116.96 34.05 Favored 'General case' 0 N--CA 1.505 2.311 0 O-C-N 121.431 -0.793 . . . . 1.05 110.022 179.531 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -91.95 22.53 4.22 Favored 'General case' 0 N--CA 1.502 2.142 0 O-C-N 120.961 -1.087 . . . . 0.73 110.265 179.204 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 67.8 m -54.52 144.42 21.38 Favored 'General case' 0 N--CA 1.492 1.638 0 O-C-N 120.666 -1.271 . . . . 0.3 110.667 -178.91 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.693 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -80.99 127.97 33.17 Favored 'General case' 0 C--N 1.306 -1.29 0 N-CA-C 107.084 -1.45 . . . . 0.22 107.084 178.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -67.94 -31.32 70.99 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.832 -1.147 . . . . 0.3 108.527 -179.372 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.693 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 69.7 p-90 -76.53 -13.53 60.08 Favored 'General case' 0 N--CA 1.491 1.611 0 O-C-N 121.342 -0.849 . . . . 0.26 111.467 -179.844 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 16.3 t -87.98 114.27 24.44 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 120.679 -1.263 . . . . 0.26 108.592 179.98 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.475 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -61.25 -51.94 54.92 Favored Glycine 0 N--CA 1.49 2.271 0 N-CA-C 110.647 -0.981 . . . . 0.23 110.647 -179.319 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.475 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 32.9 Cg_exo -50.44 -38.04 52.65 Favored 'Trans proline' 0 C--N 1.313 -1.295 0 CA-C-N 118.463 1.132 . . . . 0.31 112.183 -179.972 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.99 -43.74 23.75 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.143 -0.973 . . . . 0.24 109.66 179.678 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 62.0 tttm -59.96 -32.13 70.53 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 120.986 -1.071 . . . . 1.59 108.819 179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.435 ' O ' ' HD2' ' A' ' 40' ' ' PRO . 54.5 ttm -60.41 -29.28 68.87 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.336 -0.853 . . . . 2.1 109.828 -179.91 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.429 HD11 ' HB1' ' A' ' 92' ' ' ALA . 17.1 mt -80.29 -4.21 7.1 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.972 0 O-C-N 121.934 -0.479 . . . . 0.49 110.997 -179.279 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.542 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.69 -30.93 7.11 Favored Pre-proline 0 N--CA 1.49 1.551 0 O-C-N 119.823 -1.798 . . . . 0.8 113.724 -177.727 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.542 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.3 Cg_exo -59.5 -36.42 93.33 Favored 'Trans proline' 0 N--CA 1.489 1.234 0 CA-C-N 121.586 1.602 . . . . 0.28 112.0 -178.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.4 m-85 -72.41 -51.63 19.52 Favored 'General case' 0 N--CA 1.486 1.363 0 C-N-CA 118.686 -1.206 . . . . 0.37 108.874 -179.847 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.9 t80 -59.61 -48.28 82.27 Favored 'General case' 0 C--N 1.296 -1.73 0 N-CA-C 108.892 -0.781 . . . . 0.16 108.892 179.043 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.5 t60 -68.18 -42.46 79.94 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.298 -0.876 . . . . 0.32 110.812 179.468 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.3 m -64.52 -37.09 86.33 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 120.927 -1.108 . . . . 0.22 110.771 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 45.7 mt -62.8 -22.78 66.87 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.125 -0.984 . . . . 0.22 110.525 -178.752 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 50.2 m -53.57 -37.14 62.64 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 120.766 -1.209 . . . . 0.16 107.903 -179.266 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.497 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 55.3 mp0 -87.85 -15.34 37.05 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.556 -0.715 . . . . 2.16 109.501 179.275 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.6 tttt -76.69 -38.26 54.73 Favored 'General case' 0 N--CA 1.49 1.542 0 N-CA-C 107.254 -1.387 . . . . 1.78 107.254 178.737 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 82.4 m-85 -123.66 69.37 1.04 Allowed 'General case' 0 N--CA 1.489 1.508 0 N-CA-C 107.183 -1.414 . . . . 0.25 107.183 178.093 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 81.3 p -64.18 -8.98 14.17 Favored 'General case' 0 C--N 1.3 -1.558 0 N-CA-C 109.012 -0.736 . . . . 0.22 109.012 -179.773 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 22.8 t30 -89.07 8.54 29.3 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.621 -0.881 . . . . 1.13 108.621 178.695 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 73.4 t -127.36 146.46 33.12 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.951 0 N-CA-C 108.059 -1.089 . . . . 0.24 108.059 178.684 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.1 mm -99.79 119.75 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.074 0 O-C-N 120.997 -1.064 . . . . 0.15 109.828 -178.876 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.576 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.3 m-85 -101.15 127.85 47.52 Favored 'General case' 0 N--CA 1.504 2.264 0 O-C-N 121.273 -0.892 . . . . 0.12 109.98 179.619 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.576 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.7 mp -110.75 143.0 41.95 Favored 'General case' 0 N--CA 1.509 2.478 0 O-C-N 121.229 -0.919 . . . . 0.22 110.13 178.706 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -113.53 129.66 56.51 Favored 'General case' 0 N--CA 1.495 1.793 0 N-CA-C 106.973 -1.492 . . . . 1.13 106.973 177.741 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.5 t -127.97 132.0 69.06 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.217 0 O-C-N 121.152 -0.968 . . . . 0.15 110.914 -177.958 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 52.2 t0 -93.74 119.88 33.29 Favored 'General case' 0 N--CA 1.488 1.45 0 N-CA-C 108.815 -0.809 . . . . 1.05 108.815 179.132 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.0 m -67.19 -17.33 22.49 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 O-C-N 120.672 -1.267 . . . . 0.16 107.797 178.882 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.503 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.18 -43.97 9.05 Favored 'General case' 0 N--CA 1.491 1.62 0 O-C-N 121.358 -0.839 . . . . 1.08 111.527 -178.924 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 48.1 m-20 -94.41 -14.99 24.7 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 120.649 -1.282 . . . . 1.07 108.573 179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.02 37.62 4.37 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 107.966 -1.124 . . . . 0.14 107.966 179.761 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 7.0 pt20 -59.57 -18.14 38.46 Favored 'General case' 0 N--CA 1.493 1.703 0 O-C-N 121.8 -0.563 . . . . 1.47 110.668 -178.398 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.412 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 1.3 p30 -66.36 -43.08 87.02 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 120.838 -1.164 . . . . 1.05 108.719 179.022 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.2 t -68.72 -44.62 82.14 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 O-C-N 121.469 -0.769 . . . . 0.35 110.056 -179.903 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.25 -39.08 75.23 Favored 'General case' 0 C--N 1.303 -1.419 0 O-C-N 121.426 -0.796 . . . . 0.26 110.663 -178.689 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 94.7 p -62.62 -32.79 73.87 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 120.942 -1.099 . . . . 0.24 109.154 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 -64.05 -39.86 95.02 Favored 'General case' 0 N--CA 1.488 1.43 0 O-C-N 121.494 -0.754 . . . . 2.06 109.617 179.472 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.33 2.03 51.52 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.208 -0.932 . . . . 0.23 110.476 -179.244 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 53.14 51.55 15.44 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.322 -0.861 . . . . 2.02 108.788 -179.195 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.5 t -63.97 131.14 29.55 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.497 0 C-N-CA 118.517 -1.273 . . . . 0.16 108.391 -179.267 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.6 mmtt -103.77 -11.38 17.61 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.679 -0.638 . . . . 1.6 110.707 -178.665 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.491 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.7 154.87 18.66 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 120.709 -1.245 . . . . 0.14 111.167 179.599 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.494 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.4 p -126.34 154.53 74.77 Favored Pre-proline 0 N--CA 1.498 1.926 0 N-CA-C 108.359 -0.978 . . . . 0.15 108.359 178.93 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.35 143.69 75.54 Favored 'Cis proline' 0 N--CA 1.494 1.518 0 C-N-CA 123.829 -1.321 . . . . 0.16 112.615 -2.867 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.491 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 86.0 m -129.66 131.19 46.32 Favored 'General case' 0 N--CA 1.499 1.997 0 CA-C-O 121.556 0.693 . . . . 0.13 109.305 178.849 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 88.2 m-85 -108.59 132.76 53.54 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.6 -0.687 . . . . 0.2 109.221 -179.416 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.2 mt-30 -122.72 141.07 52.18 Favored 'General case' 0 N--CA 1.497 1.914 0 N-CA-C 108.506 -0.924 . . . . 0.29 108.506 179.245 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.3 m-85 -108.51 133.9 52.03 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.741 -0.599 . . . . 0.14 110.167 -179.2 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 74.1 m-85 -124.56 147.26 48.54 Favored 'General case' 0 N--CA 1.489 1.521 0 CA-C-O 121.502 0.668 . . . . 0.15 109.837 179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.4 tptp -144.99 128.58 17.1 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 107.87 -1.159 . . . . 1.68 107.87 -179.948 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 88.8 mttt 49.69 38.78 16.07 Favored 'General case' 0 N--CA 1.496 1.87 0 O-C-N 121.116 -0.99 . . . . 1.22 108.335 -177.457 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 69.73 24.29 76.38 Favored Glycine 0 N--CA 1.487 2.052 0 C-N-CA 119.796 -1.192 . . . . 0.23 110.169 179.657 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -128.37 135.12 49.11 Favored 'General case' 0 N--CA 1.505 2.318 0 O-C-N 121.333 -1.098 . . . . 2.07 110.339 -179.672 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.4 ttmp? -79.46 127.38 32.05 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 121.035 -1.04 . . . . 1.82 109.312 179.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.9 m -124.19 5.59 4.9 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.963 0 O-C-N 121.71 -0.619 . . . . 0.3 110.692 -179.653 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.82 154.22 13.89 Favored Glycine 0 N--CA 1.494 2.553 0 C-N-CA 118.465 -1.826 . . . . 0.17 111.476 -179.811 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.418 ' C ' ' CD ' ' A' ' 88' ' ' GLU . 5.7 tm-20 -164.88 149.71 9.39 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.788 -0.83 . . . . 1.93 109.305 179.386 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.439 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 15.1 p90 -163.18 160.97 24.75 Favored 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 119.192 -1.003 . . . . 0.14 109.524 177.586 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.73 159.99 30.9 Favored 'General case' 0 N--CA 1.5 2.053 0 CA-C-O 121.388 0.614 . . . . 0.12 109.71 -179.186 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.463 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.88 142.14 6.09 Favored Glycine 0 N--CA 1.491 2.307 0 N-CA-C 108.933 -1.667 . . . . 0.12 108.933 179.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.429 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.09 66.01 4.42 Favored 'General case' 0 C--N 1.302 -1.47 0 O-C-N 121.217 -1.167 . . . . 0.18 109.94 -179.484 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.6 t-20 -119.64 99.89 6.93 Favored 'General case' 0 N--CA 1.502 2.145 0 O-C-N 121.351 -0.843 . . . . 0.88 109.306 178.647 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.413 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.47 -33.51 74.29 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.341 -0.849 . . . . 1.06 111.672 -179.825 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 72.1 mm-40 -66.22 -27.13 67.74 Favored 'General case' 0 N--CA 1.492 1.669 0 O-C-N 120.438 -1.414 . . . . 1.61 109.376 -179.612 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 22.5 ttmt -61.13 -37.75 83.93 Favored 'General case' 0 C--N 1.3 -1.546 0 N-CA-C 108.144 -1.058 . . . . 1.45 108.144 -179.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 52.5 mt -58.63 -39.6 80.99 Favored 'General case' 0 C--N 1.303 -1.453 0 CA-C-O 122.056 0.931 . . . . 0.19 108.5 179.697 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.8 tm-20 -61.53 -43.22 99.25 Favored 'General case' 0 C--N 1.289 -2.028 0 C-N-CA 120.21 -0.596 . . . . 2.1 111.005 -178.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.53 -43.99 71.9 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.094 -1.004 . . . . 0.19 112.08 -178.065 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.6 m -64.99 -39.23 93.16 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 120.798 -1.189 . . . . 0.2 110.172 -178.628 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 52.5 mt -61.98 -49.57 83.64 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.097 -1.002 . . . . 0.16 108.377 179.595 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.432 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.8 t-20 -60.91 -35.76 77.52 Favored 'General case' 0 C--N 1.297 -1.691 0 N-CA-C 108.589 -0.893 . . . . 0.95 108.589 179.45 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . 0.423 ' OE2' ' O ' ' A' ' 103' ' ' GLU . 2.5 tm-20 -68.25 -39.1 82.35 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.695 -0.628 . . . . 2.21 110.166 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 89.0 mt -98.91 -6.5 28.77 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.002 -1.061 . . . . 0.25 111.534 -178.878 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.465 HG13 ' O ' ' A' ' 105' ' ' VAL . 7.9 p . . . . . 0 N--CA 1.501 2.101 0 O-C-N 120.441 -1.412 . . . . 1.08 109.657 -179.066 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.0 Cg_exo . . . . . 0 N--CA 1.496 1.657 0 CA-C-O 121.206 0.419 . . . . 1.46 112.377 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.2 124.98 39.53 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.199 -0.938 . . . . 0.88 108.84 179.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.456 ' O ' ' O ' ' B' ' 64' ' ' ILE . 21.3 m -107.33 129.98 54.83 Favored 'General case' 0 N--CA 1.499 1.988 0 O-C-N 121.347 -0.845 . . . . 0.7 109.18 -179.633 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 51.5 mt -67.77 -29.21 68.36 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 121.276 -0.89 . . . . 0.61 109.018 179.776 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.456 ' H ' HG22 ' B' ' 61' ' ' THR . 67.2 mmtt -64.4 -19.59 65.6 Favored 'General case' 0 C--N 1.301 -1.54 0 O-C-N 121.352 -0.843 . . . . 1.31 108.765 -179.328 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.463 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.4 mm -130.07 140.32 49.24 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.495 0 O-C-N 121.794 -0.566 . . . . 0.15 109.571 -179.875 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -99.83 129.83 45.97 Favored 'General case' 0 N--CA 1.504 2.248 0 N-CA-C 106.759 -1.571 . . . . 0.19 106.759 177.76 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.1 m -81.46 138.4 35.52 Favored 'General case' 0 N--CA 1.5 2.052 0 O-C-N 120.535 -1.353 . . . . 0.2 111.321 -178.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.494 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.2 m95 -72.11 -9.79 58.9 Favored 'General case' 0 N--CA 1.499 2.003 0 O-C-N 121.064 -1.022 . . . . 0.21 109.572 178.845 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.3 m120 -52.91 -12.32 0.31 Allowed 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.427 -0.796 . . . . 0.49 109.272 -179.907 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.496 HG11 ' CH2' ' A' ' 31' ' ' TRP . 10.8 m -57.68 139.31 17.47 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.386 0 O-C-N 121.319 -0.863 . . . . 1.04 109.264 179.37 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 64.2 m-20 -59.77 -39.17 83.94 Favored 'General case' 0 C--N 1.3 -1.581 0 O-C-N 120.874 -1.141 . . . . 1.36 109.529 -179.466 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.326 0 CA-C-O 118.18 -1.345 . . . . 2.32 110.248 -179.581 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 17.5 tpt . . . . . 0 N--CA 1.49 1.565 0 N-CA-C 109.178 -0.675 . . . . 2.88 109.178 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.46 HG12 ' N ' ' A' ' 3' ' ' LYS . 95.6 t -98.71 159.22 3.4 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.909 0 O-C-N 121.464 -0.773 . . . . 0.45 109.465 -179.642 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.46 ' N ' HG12 ' A' ' 2' ' ' VAL . 80.2 tttt -129.88 124.44 33.2 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.414 -0.804 . . . . 1.67 108.885 -179.93 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 61.6 tt0 -94.3 124.12 38.12 Favored 'General case' 0 N--CA 1.49 1.554 0 N-CA-C 108.359 -0.978 . . . . 0.31 108.359 179.827 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.7 mm -100.16 112.85 33.95 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.465 0 N-CA-C 108.478 -0.934 . . . . 0.19 108.478 -179.93 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.454 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -97.39 -0.26 46.61 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.063 -1.023 . . . . 2.25 109.652 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -155.16 159.15 39.94 Favored 'General case' 0 N--CA 1.5 2.027 0 O-C-N 120.993 -1.067 . . . . 0.15 111.216 179.744 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.6 ttmt -63.5 -32.34 73.76 Favored 'General case' 0 C--N 1.305 -1.341 0 N-CA-C 108.073 -1.084 . . . . 1.65 108.073 178.142 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.432 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 88.1 m -57.76 -48.35 79.9 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.665 -0.814 . . . . 0.23 108.813 -179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.88 -30.86 69.45 Favored 'General case' 0 C--N 1.297 -1.69 0 O-C-N 121.259 -0.901 . . . . 0.17 108.715 178.679 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.539 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.1 t80 -59.33 -43.87 92.69 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.149 -0.969 . . . . 0.14 109.06 -179.57 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.9 mm100 -66.35 -42.99 87.27 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 120.046 -0.662 . . . . 1.31 109.449 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.543 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -65.12 -39.94 93.79 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.69 -0.631 . . . . 1.77 110.328 179.629 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.62 -39.73 88.46 Favored 'General case' 0 C--N 1.302 -1.485 0 O-C-N 121.081 -1.012 . . . . 0.15 109.446 -179.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.539 HD11 ' CE2' ' A' ' 11' ' ' PHE . 63.8 mt -60.71 -39.94 90.42 Favored 'General case' 0 C--N 1.307 -1.279 0 N-CA-C 108.162 -1.051 . . . . 0.17 108.162 179.329 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.3 t0 -69.84 -36.96 75.99 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.674 -0.641 . . . . 1.07 110.205 -179.975 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.76 -37.48 82.17 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.51 -0.744 . . . . 0.18 109.926 -178.716 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.51 -32.07 72.93 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.307 -0.871 . . . . 0.17 109.649 -179.958 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -125.87 24.67 Favored Glycine 0 N--CA 1.492 2.431 0 N-CA-C 110.015 -1.234 . . . . 0.2 110.015 -179.926 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.5 m-20 -92.02 5.9 48.42 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.107 -1.231 . . . . 1.07 110.203 -179.331 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 67.5 mttt -76.39 149.36 36.93 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 120.838 -1.164 . . . . 1.5 109.472 179.897 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.676 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.05 155.53 16.78 Favored 'General case' 0 C--N 1.307 -1.27 0 N-CA-C 107.523 -1.288 . . . . 0.47 107.523 -179.995 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.655 ' H ' HD23 ' A' ' 22' ' ' LEU . 64.7 t -143.22 111.54 1.87 Allowed 'Isoleucine or valine' 0 N--CA 1.486 1.368 0 O-C-N 120.919 -1.113 . . . . 0.17 109.059 -179.704 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 26.0 t -100.65 141.88 16.67 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 N-CA-C 107.91 -1.145 . . . . 0.14 107.91 179.765 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.2 t -124.06 124.31 68.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.076 0 O-C-N 121.341 -0.85 . . . . 0.13 109.443 -179.346 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.5 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 35.5 t70 -101.8 119.1 38.25 Favored 'General case' 0 N--CA 1.498 1.959 0 O-C-N 121.637 -0.664 . . . . 1.05 110.144 179.649 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -95.91 23.17 6.58 Favored 'General case' 0 N--CA 1.501 2.08 0 O-C-N 121.348 -0.845 . . . . 0.73 109.95 179.326 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.415 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.5 m -59.02 145.25 42.58 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 120.844 -1.16 . . . . 0.3 110.385 -178.485 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.582 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.05 126.81 33.42 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 107.547 -1.279 . . . . 0.22 107.547 179.039 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -68.27 -28.31 67.09 Favored 'General case' 0 C--N 1.297 -1.686 0 C-N-CA 118.848 -1.141 . . . . 0.3 108.781 179.97 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.582 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.8 p-90 -77.42 -19.22 56.4 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 121.079 -1.013 . . . . 0.26 110.072 179.991 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.4 ' HB3' ' HB3' ' A' ' 35' ' ' ALA . 34.2 t -83.84 122.45 28.71 Favored 'General case' 0 C--N 1.303 -1.433 0 N-CA-C 108.167 -1.049 . . . . 0.26 108.167 -179.612 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.49 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.6 -54.08 34.11 Favored Glycine 0 N--CA 1.488 2.113 0 C-N-CA 120.728 -0.749 . . . . 0.23 111.977 -178.251 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.49 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.3 Cg_endo -59.53 -31.04 93.93 Favored 'Trans proline' 0 C--N 1.314 -1.255 0 CA-C-N 119.588 1.694 . . . . 0.31 112.404 179.973 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.415 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -76.69 -55.48 5.46 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.036 -1.04 . . . . 0.24 109.805 179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.2 tttm -60.16 -38.43 83.15 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 120.942 -1.099 . . . . 1.59 110.25 179.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.51 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.33 -28.79 67.14 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.088 -1.008 . . . . 2.1 109.677 -179.16 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.589 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.8 mt -83.36 -3.86 7.85 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.847 0 O-C-N 121.751 -0.593 . . . . 0.49 111.312 -179.825 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.569 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.4 ptmt -66.67 -29.83 3.0 Favored Pre-proline 0 N--CA 1.498 1.946 0 O-C-N 120.262 -1.524 . . . . 0.8 113.468 -177.372 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.569 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.3 Cg_exo -54.74 -39.83 87.59 Favored 'Trans proline' 0 N--CA 1.493 1.444 0 CA-C-N 121.759 1.664 . . . . 0.28 112.409 -177.221 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.434 ' CD2' ' HG3' ' A' ' 94' ' ' LYS . 32.4 m-85 -68.74 -44.05 74.61 Favored 'General case' 0 C--N 1.3 -1.569 0 C-N-CA 118.187 -1.405 . . . . 0.37 108.134 179.487 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 83.1 t80 -60.34 -54.18 48.77 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.33 -0.856 . . . . 0.16 109.533 177.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.443 ' CE1' HG21 ' A' ' 2' ' ' VAL . 44.3 t60 -66.98 -39.92 87.29 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.82 -0.55 . . . . 0.32 110.554 -179.593 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.438 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 75.7 m -61.47 -37.79 84.91 Favored 'General case' 0 N--CA 1.497 1.904 0 O-C-N 120.87 -1.144 . . . . 0.22 110.286 179.796 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 26.3 mt -60.99 -23.6 65.49 Favored 'General case' 0 N--CA 1.495 1.804 0 O-C-N 121.334 -0.854 . . . . 0.22 110.298 -178.869 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.0 m -54.79 -38.94 67.91 Favored 'General case' 0 C--N 1.299 -1.626 0 O-C-N 121.069 -1.02 . . . . 0.16 108.915 -179.4 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.8 mp0 -87.87 -13.51 41.85 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.225 -0.922 . . . . 2.16 109.733 -179.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 1.8 tmtt? -80.34 -37.49 32.42 Favored 'General case' 0 C--N 1.3 -1.576 0 N-CA-C 105.76 -1.941 . . . . 1.78 105.76 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.0 m-85 -123.1 66.75 0.98 Allowed 'General case' 0 N--CA 1.491 1.581 0 N-CA-C 107.199 -1.408 . . . . 0.25 107.199 178.635 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 79.3 p -62.33 -8.32 5.73 Favored 'General case' 0 C--N 1.305 -1.338 0 N-CA-C 108.952 -0.759 . . . . 0.22 108.952 -179.475 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.6 t30 -91.03 9.72 29.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 108.737 -0.838 . . . . 1.13 108.737 178.968 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.469 HG13 ' HB3' ' A' ' 22' ' ' LEU . 46.5 t -129.3 147.01 33.36 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.874 0 N-CA-C 108.169 -1.048 . . . . 0.24 108.169 178.771 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.8 mm -100.8 120.1 49.84 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.185 0 O-C-N 120.961 -1.087 . . . . 0.15 110.165 -178.921 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.477 ' C ' HD12 ' A' ' 55' ' ' LEU . 29.3 m-85 -102.28 127.84 49.08 Favored 'General case' 0 N--CA 1.504 2.233 0 O-C-N 120.985 -1.072 . . . . 0.12 109.348 179.352 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.477 HD12 ' C ' ' A' ' 54' ' ' PHE . 1.9 mp -110.02 140.3 44.19 Favored 'General case' 0 N--CA 1.505 2.324 0 O-C-N 121.245 -0.909 . . . . 0.22 109.389 179.54 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.7 tt0 -110.4 129.52 55.74 Favored 'General case' 0 N--CA 1.492 1.655 0 N-CA-C 106.69 -1.596 . . . . 1.13 106.69 177.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.9 t -126.67 129.87 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.997 0 CA-C-O 121.555 0.693 . . . . 0.15 110.252 -178.188 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.56 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 55.7 t0 -93.24 119.58 32.57 Favored 'General case' 0 C--N 1.3 -1.559 0 N-CA-C 108.333 -0.988 . . . . 1.05 108.333 179.052 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.2 m -67.29 -20.46 26.7 Favored 'Isoleucine or valine' 0 C--N 1.293 -1.851 0 C-N-CA 118.301 -1.36 . . . . 0.16 108.186 179.454 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.541 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.39 -42.12 10.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.433 -0.792 . . . . 1.08 111.696 -178.929 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.441 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 22.0 m-20 -96.18 -13.86 23.2 Favored 'General case' 0 N--CA 1.504 2.247 0 O-C-N 120.688 -1.257 . . . . 1.07 108.412 179.643 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.56 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -126.06 40.05 3.81 Favored 'General case' 0 N--CA 1.492 1.626 0 N-CA-C 107.703 -1.221 . . . . 0.14 107.703 179.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 15.0 pt20 -59.86 -24.81 64.53 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.841 -0.537 . . . . 1.47 109.969 -178.618 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.608 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -65.52 -39.36 91.71 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 120.79 -1.194 . . . . 1.05 109.497 179.811 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.608 HG23 ' OD1' ' A' ' 64' ' ' ASP . 15.2 t -69.92 -44.3 78.8 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.467 0 O-C-N 121.133 -0.979 . . . . 0.35 109.669 179.86 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -73.08 -36.52 66.85 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 121.681 -0.637 . . . . 0.26 110.847 -178.976 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.8 p -60.55 -36.8 79.34 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.134 -0.979 . . . . 0.24 109.573 -179.146 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.3 -37.08 85.85 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.292 -0.88 . . . . 2.06 109.537 179.603 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.459 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.13 -0.15 53.59 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.15 -0.969 . . . . 0.23 111.04 -178.551 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.2 mp0 54.38 49.41 18.5 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.984 -1.073 . . . . 2.02 109.845 179.942 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.0 t -67.85 134.35 30.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.554 0 O-C-N 120.833 -1.167 . . . . 0.16 108.763 -179.676 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.8 mmtp -106.43 -12.48 15.63 Favored 'General case' 0 N--CA 1.493 1.691 0 O-C-N 121.527 -0.733 . . . . 1.6 110.474 -179.08 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.487 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -161.26 153.37 19.86 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 120.836 -1.165 . . . . 0.14 110.562 -179.512 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -125.2 155.65 70.88 Favored Pre-proline 0 N--CA 1.499 2.016 0 N-CA-C 107.861 -1.163 . . . . 0.15 107.861 178.985 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.9 Cg_endo -76.35 145.09 81.22 Favored 'Cis proline' 0 N--CA 1.491 1.341 0 C-N-CA 123.724 -1.365 . . . . 0.16 112.514 -2.459 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.452 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.7 m -129.45 132.2 46.91 Favored 'General case' 0 N--CA 1.498 1.961 0 N-CA-C 108.735 -0.839 . . . . 0.13 108.735 178.443 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.729 ' CD1' HD21 ' A' ' 97' ' ' LEU . 91.0 m-85 -110.16 130.76 55.49 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 109.109 -0.7 . . . . 0.2 109.109 -179.191 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.459 HE22 ' HB1' ' A' ' 69' ' ' ALA . 72.2 mt-30 -122.82 139.34 54.12 Favored 'General case' 0 N--CA 1.496 1.856 0 N-CA-C 108.739 -0.838 . . . . 0.29 108.739 179.168 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.4 m-85 -106.83 132.06 53.22 Favored 'General case' 0 C--N 1.298 -1.651 0 CA-C-O 121.356 0.598 . . . . 0.14 110.197 -179.191 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.3 m-85 -125.94 147.75 49.42 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.181 -0.674 . . . . 0.15 109.181 179.401 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.0 tttm -147.18 125.54 12.32 Favored 'General case' 0 N--CA 1.49 1.567 0 N-CA-C 107.483 -1.303 . . . . 1.68 107.483 179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.1 mttt 59.58 28.22 17.58 Favored 'General case' 0 N--CA 1.492 1.632 0 N-CA-C 107.195 -1.409 . . . . 1.22 107.195 -178.359 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.455 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 76.34 16.24 80.86 Favored Glycine 0 N--CA 1.489 2.22 0 N-CA-C 109.996 -1.242 . . . . 0.23 109.996 -179.395 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.455 HE21 ' C ' ' A' ' 83' ' ' GLY . 7.0 mm-40 -115.57 132.94 56.47 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.472 -1.016 . . . . 2.07 110.467 -179.718 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 24.3 ttpp -77.14 124.22 27.5 Favored 'General case' 0 N--CA 1.497 1.908 0 N-CA-C 107.896 -1.15 . . . . 1.82 107.896 178.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.8 m -123.52 11.88 5.18 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.757 0 O-C-N 121.696 -0.627 . . . . 0.3 110.06 -178.907 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 177.23 156.03 15.08 Favored Glycine 0 N--CA 1.49 2.278 0 C-N-CA 118.909 -1.615 . . . . 0.17 111.251 179.753 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.4 tm-20 -166.4 148.0 6.55 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.886 -0.773 . . . . 1.93 109.223 178.929 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.573 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 7.1 p90 -164.47 159.04 18.99 Favored 'General case' 0 C--N 1.3 -1.548 0 C-N-CA 119.828 -0.749 . . . . 0.14 109.523 178.532 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.67 161.39 28.19 Favored 'General case' 0 N--CA 1.497 1.892 0 CA-C-O 121.558 0.694 . . . . 0.12 110.022 -179.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.439 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.98 142.1 5.93 Favored Glycine 0 N--CA 1.49 2.292 0 N-CA-C 109.519 -1.433 . . . . 0.12 109.519 179.326 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.566 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.26 65.06 2.78 Favored 'General case' 0 C--N 1.302 -1.478 0 O-C-N 121.341 -1.094 . . . . 0.18 109.721 -179.556 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 31.2 t-20 -120.04 90.82 3.4 Favored 'General case' 0 N--CA 1.502 2.144 0 N-CA-C 108.398 -0.964 . . . . 0.88 108.398 178.311 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.492 ' H ' ' CD ' ' A' ' 94' ' ' LYS . 0.2 OUTLIER -64.47 -35.13 79.95 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.068 -1.02 . . . . 1.06 111.546 -179.173 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 55.0 mm-40 -62.04 -30.06 70.71 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.798 -1.189 . . . . 1.61 109.969 -179.609 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.573 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 58.3 tttm -61.46 -32.91 72.91 Favored 'General case' 0 N--CA 1.494 1.766 0 CA-C-O 121.669 0.747 . . . . 1.45 109.314 -179.183 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.729 HD21 ' CD1' ' A' ' 77' ' ' PHE . 47.0 mt -59.62 -39.68 85.04 Favored 'General case' 0 C--N 1.294 -1.811 0 N-CA-C 108.215 -1.031 . . . . 0.19 108.215 179.408 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 9.7 tp10 -61.47 -41.36 97.12 Favored 'General case' 0 C--N 1.299 -1.61 0 C-N-CA 120.073 -0.651 . . . . 2.1 110.547 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.82 -43.45 75.54 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.087 -1.008 . . . . 0.19 111.698 -178.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.8 m -67.3 -36.09 80.81 Favored 'General case' 0 N--CA 1.493 1.698 0 O-C-N 120.757 -1.214 . . . . 0.2 109.949 -178.634 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 62.9 mt -63.7 -50.11 79.34 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 121.061 -1.024 . . . . 0.16 108.35 179.443 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.476 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.3 t30 -60.03 -34.47 73.42 Favored 'General case' 0 C--N 1.298 -1.66 0 N-CA-C 108.256 -1.016 . . . . 0.95 108.256 179.266 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -68.07 -39.97 82.82 Favored 'General case' 0 C--N 1.296 -1.744 0 O-C-N 121.752 -0.592 . . . . 2.21 110.406 -178.864 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.676 ' HB2' HD11 ' A' ' 22' ' ' LEU . 94.8 mt -98.95 -2.99 36.07 Favored 'General case' 0 N--CA 1.502 2.16 0 O-C-N 121.218 -0.926 . . . . 0.25 111.293 -179.135 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.476 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.2 p . . . . . 0 N--CA 1.496 1.87 0 O-C-N 120.413 -1.43 . . . . 1.08 109.11 -179.535 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_exo . . . . . 0 N--CA 1.493 1.459 0 CA-C-O 120.899 0.291 . . . . 1.46 112.424 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.09 124.14 36.85 Favored 'General case' 0 N--CA 1.498 1.956 0 O-C-N 121.098 -1.001 . . . . 0.88 108.809 179.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.418 HG22 ' H ' ' B' ' 63' ' ' LYS . 28.5 m -100.07 129.88 46.16 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.29 -0.881 . . . . 0.7 109.749 -179.49 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 83.3 mt -68.15 -30.66 69.84 Favored 'General case' 0 N--CA 1.495 1.78 0 O-C-N 121.498 -0.751 . . . . 0.61 109.782 179.686 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.418 ' H ' HG22 ' B' ' 61' ' ' THR . 63.2 mmtt -61.17 -16.83 48.93 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.499 -0.751 . . . . 1.31 109.674 -179.001 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.487 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 32.7 mm -129.02 140.11 50.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.166 0 N-CA-C 109.259 -0.645 . . . . 0.15 109.259 -179.731 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.0 m -98.29 131.55 44.52 Favored 'General case' 0 N--CA 1.499 1.977 0 N-CA-C 107.272 -1.381 . . . . 0.19 107.272 177.659 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 52.9 m -81.46 140.12 34.8 Favored 'General case' 0 N--CA 1.501 2.1 0 O-C-N 120.614 -1.304 . . . . 0.2 111.29 -178.66 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.456 ' C ' ' N ' ' B' ' 69' ' ' VAL . 25.1 m95 -74.22 -10.1 59.27 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.203 -0.936 . . . . 0.21 109.697 179.021 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.435 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.9 m120 -52.0 -12.03 0.2 Allowed 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.008 -1.057 . . . . 0.49 108.76 179.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.456 ' N ' ' C ' ' B' ' 67' ' ' TRP . 17.3 m -63.48 143.8 15.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.507 0 O-C-N 121.177 -0.952 . . . . 1.04 109.27 179.458 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 68.5 m-20 -59.57 -37.92 79.77 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.159 -0.963 . . . . 1.36 109.282 -179.694 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 2.027 0 N-CA-C 109.128 -1.589 . . . . 2.32 109.128 -179.418 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.413 ' SD ' ' OE2' ' A' ' 47' ' ' GLU . 36.0 mmt . . . . . 0 N--CA 1.49 1.532 0 N-CA-C 108.689 -0.856 . . . . 2.88 108.689 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.5 t -99.82 136.5 30.83 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.964 0 O-C-N 121.24 -0.913 . . . . 0.45 109.515 -179.954 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 46.9 tptt -129.89 126.31 37.64 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.122 -1.066 . . . . 1.67 108.122 179.574 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -97.13 123.24 40.84 Favored 'General case' 0 N--CA 1.492 1.642 0 N-CA-C 108.339 -0.986 . . . . 0.31 108.339 179.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 33.0 mm -100.3 112.8 34.01 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.463 0 N-CA-C 108.774 -0.824 . . . . 0.19 108.774 179.772 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.4 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.1 mp0 -94.63 -2.01 52.15 Favored 'General case' 0 N--CA 1.485 1.325 0 O-C-N 120.916 -1.115 . . . . 2.25 110.203 -179.862 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.2 p -152.21 154.08 35.08 Favored 'General case' 0 N--CA 1.494 1.732 0 O-C-N 120.659 -1.275 . . . . 0.15 110.801 179.958 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 25.7 ttpt -63.45 -32.42 73.86 Favored 'General case' 0 C--N 1.302 -1.484 0 N-CA-C 108.258 -1.016 . . . . 1.65 108.258 178.356 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 32.6 m -57.89 -46.73 84.48 Favored 'General case' 0 C--N 1.303 -1.44 0 C-N-CA 119.285 -0.966 . . . . 0.23 108.651 -179.896 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.12 -29.53 67.61 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.412 -0.805 . . . . 0.17 108.992 179.143 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.401 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.6 t80 -59.85 -44.09 94.31 Favored 'General case' 0 N--CA 1.488 1.456 0 N-CA-C 108.479 -0.934 . . . . 0.14 108.479 -179.911 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 97.5 mm-40 -64.32 -43.64 94.03 Favored 'General case' 0 C--N 1.3 -1.556 0 N-CA-C 109.016 -0.735 . . . . 1.31 109.016 179.876 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.2 mm-40 -64.29 -35.8 82.03 Favored 'General case' 0 N--CA 1.493 1.705 0 CA-C-O 121.376 0.608 . . . . 1.77 109.819 179.828 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.04 -41.67 81.7 Favored 'General case' 0 C--N 1.302 -1.493 0 O-C-N 121.271 -0.893 . . . . 0.15 109.045 -179.693 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.401 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.6 mt -61.0 -41.22 96.09 Favored 'General case' 0 C--N 1.302 -1.459 0 C-N-CA 119.104 -1.038 . . . . 0.17 108.668 -179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 57.1 t0 -69.5 -39.28 77.68 Favored 'General case' 0 C--N 1.304 -1.38 0 O-C-N 121.399 -0.813 . . . . 1.07 110.528 179.944 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.05 -35.36 80.32 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 121.257 -0.902 . . . . 0.18 110.405 -178.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.82 -28.62 69.99 Favored 'General case' 0 N--CA 1.495 1.822 0 O-C-N 121.162 -0.961 . . . . 0.17 110.257 -179.616 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.02 -130.7 30.33 Favored Glycine 0 N--CA 1.493 2.445 0 N-CA-C 110.045 -1.222 . . . . 0.2 110.045 -179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 25.9 m-20 -89.97 2.47 55.08 Favored 'General case' 0 N--CA 1.495 1.799 0 O-C-N 121.124 -1.221 . . . . 1.07 110.698 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 36.1 mtmm -76.73 150.44 36.26 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 120.902 -1.124 . . . . 1.5 109.474 -179.918 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.461 ' HA ' HD23 ' A' ' 22' ' ' LEU . 12.2 mt -57.97 158.64 6.42 Favored 'General case' 0 N--CA 1.486 1.329 0 O-C-N 121.106 -0.996 . . . . 0.47 111.011 179.581 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . . . . . . . . . 45.1 t -147.06 108.98 0.69 Allowed 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 N-CA-C 108.432 -0.951 . . . . 0.17 108.432 179.201 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.401 HG22 ' CD2' ' A' ' 79' ' ' PHE . 58.7 t -101.48 143.53 14.35 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.558 0 N-CA-C 107.227 -1.397 . . . . 0.14 107.227 179.457 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 21.8 t -125.18 123.24 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.016 0 O-C-N 121.319 -0.863 . . . . 0.13 110.139 -178.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.522 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.2 t70 -98.16 123.57 42.28 Favored 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 109.006 -0.738 . . . . 1.05 109.006 179.105 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 49.8 m-85 -99.72 24.34 8.46 Favored 'General case' 0 N--CA 1.505 2.32 0 O-C-N 120.997 -1.065 . . . . 0.73 109.601 179.817 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.424 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 46.8 m -58.47 147.9 30.14 Favored 'General case' 0 C--N 1.295 -1.779 0 O-C-N 121.09 -1.006 . . . . 0.3 110.498 -178.428 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.6 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.44 127.29 34.34 Favored 'General case' 0 C--N 1.305 -1.348 0 N-CA-C 107.422 -1.325 . . . . 0.22 107.422 178.96 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.2 t -66.93 -30.92 71.19 Favored 'General case' 0 C--N 1.299 -1.621 0 C-N-CA 118.695 -1.202 . . . . 0.3 108.949 -179.488 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.6 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 64.0 p-90 -76.61 -16.48 59.56 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.09 -1.006 . . . . 0.26 111.565 179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 12.8 t -86.38 114.0 22.8 Favored 'General case' 0 N--CA 1.492 1.66 0 O-C-N 120.616 -1.302 . . . . 0.26 108.408 -179.536 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.45 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -59.98 -51.37 59.3 Favored Glycine 0 N--CA 1.491 2.335 0 C-N-CA 120.317 -0.944 . . . . 0.23 111.232 -178.628 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.45 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 32.8 Cg_exo -50.44 -37.6 51.71 Favored 'Trans proline' 0 C--N 1.311 -1.4 0 CA-C-N 118.96 1.38 . . . . 0.31 112.396 -179.801 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.424 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.85 -44.17 28.08 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.272 -0.893 . . . . 0.24 109.331 179.807 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.1 tttt -59.85 -32.02 70.29 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.534 -0.913 . . . . 1.59 108.534 179.355 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 20.8 ttt -60.14 -29.3 68.55 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 121.582 -0.699 . . . . 2.1 109.797 -179.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.492 HD11 ' HB1' ' A' ' 92' ' ' ALA . 8.6 mt -83.01 -4.65 8.4 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.969 0 O-C-N 121.512 -0.743 . . . . 0.49 110.833 -179.525 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.535 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.18 -32.45 10.83 Favored Pre-proline 0 N--CA 1.494 1.756 0 O-C-N 119.701 -1.874 . . . . 0.8 113.131 -176.986 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.535 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 26.7 Cg_exo -58.82 -36.53 96.86 Favored 'Trans proline' 0 N--CA 1.493 1.446 0 CA-C-N 121.675 1.634 . . . . 0.28 112.046 -178.226 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 54.9 m-85 -72.41 -51.88 18.46 Favored 'General case' 0 N--CA 1.489 1.498 0 O-C-N 120.822 -1.174 . . . . 0.37 109.007 179.886 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -59.37 -46.85 87.5 Favored 'General case' 0 N--CA 1.494 1.764 0 CA-C-O 122.155 0.979 . . . . 0.16 108.744 179.275 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 52.0 t60 -68.07 -46.88 69.82 Favored 'General case' 0 C--N 1.299 -1.629 0 CA-C-N 115.918 -0.583 . . . . 0.32 110.866 179.34 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.445 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 72.8 m -60.88 -38.87 87.1 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.091 -1.005 . . . . 0.22 110.343 -179.531 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.0 mt -61.32 -24.52 66.5 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.263 -0.898 . . . . 0.22 111.07 -178.215 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.4 m -54.1 -37.75 64.62 Favored 'General case' 0 C--N 1.297 -1.702 0 O-C-N 120.659 -1.275 . . . . 0.16 108.109 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.413 ' OE2' ' SD ' ' A' ' 1' ' ' MET . 73.0 mm-40 -85.44 -18.22 34.24 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.917 -1.114 . . . . 2.16 109.789 178.68 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.3 tttp -74.84 -37.03 62.35 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.052 -1.462 . . . . 1.78 107.052 179.145 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.3 m-85 -122.99 68.07 0.98 Allowed 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 107.243 -1.391 . . . . 0.25 107.243 177.81 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.6 p -64.7 -8.71 15.7 Favored 'General case' 0 N--CA 1.486 1.354 0 N-CA-C 108.97 -0.752 . . . . 0.22 108.97 -179.889 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 39.0 t30 -91.66 6.72 44.72 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 108.385 -0.968 . . . . 1.13 108.385 179.004 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 85.4 t -126.02 146.02 32.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.629 0 N-CA-C 107.73 -1.211 . . . . 0.24 107.73 179.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 28.2 mm -99.1 124.88 52.63 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.039 0 O-C-N 121.132 -0.98 . . . . 0.15 109.73 -178.91 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.53 ' C ' HD12 ' A' ' 55' ' ' LEU . 47.1 m-85 -107.09 127.74 53.75 Favored 'General case' 0 N--CA 1.507 2.406 0 O-C-N 121.288 -0.882 . . . . 0.12 109.529 179.41 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.53 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -110.93 140.21 45.62 Favored 'General case' 0 N--CA 1.509 2.501 0 O-C-N 121.047 -1.033 . . . . 0.22 110.056 178.851 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 36.7 tt0 -109.77 129.89 55.57 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 106.52 -1.659 . . . . 1.13 106.52 177.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.6 t -125.37 135.09 65.1 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.253 0 O-C-N 121.193 -0.942 . . . . 0.15 110.109 -178.695 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.438 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 52.5 t0 -98.19 117.44 32.57 Favored 'General case' 0 C--N 1.303 -1.429 0 N-CA-C 108.745 -0.835 . . . . 1.05 108.745 179.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.5 m -65.01 -19.47 25.72 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 O-C-N 120.526 -1.359 . . . . 0.16 108.19 179.005 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.7 m-20 -91.19 -41.19 11.13 Favored 'General case' 0 N--CA 1.493 1.679 0 O-C-N 121.253 -0.904 . . . . 1.08 111.949 -178.253 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 84.2 m-20 -97.49 -18.36 19.06 Favored 'General case' 0 N--CA 1.504 2.261 0 O-C-N 120.611 -1.306 . . . . 1.07 108.826 179.788 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.438 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -120.31 39.1 3.8 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 107.925 -1.139 . . . . 0.14 107.925 179.312 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.9 pt20 -60.06 -19.56 53.59 Favored 'General case' 0 C--N 1.298 -1.644 0 O-C-N 121.745 -0.597 . . . . 1.47 109.702 -178.742 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.594 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -63.55 -35.76 81.54 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 120.894 -1.129 . . . . 1.05 109.066 179.657 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.594 HG23 ' OD1' ' A' ' 64' ' ' ASP . 13.2 t -73.4 -41.31 56.98 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 O-C-N 121.067 -1.021 . . . . 0.35 108.951 179.308 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.69 -41.91 78.52 Favored 'General case' 0 N--CA 1.495 1.782 0 O-C-N 121.64 -0.663 . . . . 0.26 110.638 -179.257 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 81.0 p -60.01 -39.14 84.77 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 120.842 -1.161 . . . . 0.24 108.847 -179.138 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.5 tt0 -65.79 -40.06 91.59 Favored 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.352 -0.842 . . . . 2.06 109.465 179.195 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.61 -3.9 58.96 Favored 'General case' 0 N--CA 1.497 1.897 0 O-C-N 121.203 -0.935 . . . . 0.23 111.388 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 26.9 mp0 53.35 49.67 19.21 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 120.834 -1.166 . . . . 2.02 110.476 179.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 39.0 t -67.08 132.83 32.16 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.589 0 O-C-N 120.602 -1.311 . . . . 0.16 108.52 -179.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -103.68 -12.16 17.19 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.396 -0.815 . . . . 1.6 110.67 -179.41 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.508 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -158.4 155.36 28.51 Favored 'General case' 0 N--CA 1.495 1.817 0 O-C-N 120.709 -1.245 . . . . 0.14 110.905 179.85 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.44 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.9 p -129.8 154.58 81.06 Favored Pre-proline 0 N--CA 1.497 1.916 0 N-CA-C 108.007 -1.108 . . . . 0.15 108.007 179.211 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.7 Cg_endo -77.04 141.92 70.8 Favored 'Cis proline' 0 N--CA 1.49 1.309 0 C-N-CA 123.666 -1.389 . . . . 0.16 112.462 -2.755 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.449 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.8 m -125.95 136.13 52.65 Favored 'General case' 0 N--CA 1.493 1.719 0 N-CA-C 108.659 -0.867 . . . . 0.13 108.659 178.411 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.764 ' CD1' HD21 ' A' ' 97' ' ' LEU . 88.9 m-85 -111.75 132.95 54.31 Favored 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 108.505 -0.924 . . . . 0.2 108.505 179.891 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 75.1 mt-30 -123.83 143.23 50.46 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.661 -0.866 . . . . 0.29 108.661 179.321 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.401 ' CD2' HG22 ' A' ' 24' ' ' VAL . 59.4 m-85 -108.65 129.74 55.34 Favored 'General case' 0 N--CA 1.495 1.807 0 CA-C-O 121.468 0.651 . . . . 0.14 110.722 -179.277 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.2 m-85 -124.15 142.26 51.37 Favored 'General case' 0 N--CA 1.49 1.548 0 N-CA-C 108.86 -0.793 . . . . 0.15 108.86 178.485 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 49.2 tttm -146.44 127.05 14.2 Favored 'General case' 0 N--CA 1.489 1.502 0 N-CA-C 107.531 -1.285 . . . . 1.68 107.531 179.301 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 80.8 mttt 60.07 28.88 18.48 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.433 -0.792 . . . . 1.22 109.282 -178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.94 14.42 82.02 Favored Glycine 0 N--CA 1.495 2.63 0 O-C-N 120.857 -1.152 . . . . 0.23 110.664 179.699 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -124.11 144.3 49.96 Favored 'General case' 0 N--CA 1.5 2.07 0 O-C-N 121.335 -1.097 . . . . 2.07 110.877 -179.478 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -81.92 126.71 32.23 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.593 -0.692 . . . . 1.82 109.16 179.249 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 15.3 m -122.67 9.58 5.51 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.814 0 O-C-N 121.617 -0.677 . . . . 0.3 110.707 -179.564 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.23 162.56 28.69 Favored Glycine 0 N--CA 1.491 2.344 0 C-N-CA 118.239 -1.934 . . . . 0.17 111.471 -179.794 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.485 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -168.42 148.05 4.53 Favored 'General case' 0 N--CA 1.489 1.479 0 N-CA-C 108.97 -0.752 . . . . 1.93 108.97 179.586 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.485 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 4.1 p90 -167.78 156.01 9.07 Favored 'General case' 0 N--CA 1.499 1.993 0 O-C-N 121.197 -0.94 . . . . 0.14 109.664 177.503 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.9 p -126.34 160.0 31.61 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.563 -0.71 . . . . 0.12 109.997 -179.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.44 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.14 141.51 5.78 Favored Glycine 0 N--CA 1.494 2.523 0 N-CA-C 109.471 -1.452 . . . . 0.12 109.471 179.127 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.492 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.16 65.41 2.13 Favored 'General case' 0 N--CA 1.486 1.36 0 O-C-N 121.288 -1.125 . . . . 0.18 110.056 -179.81 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.52 97.71 5.78 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.642 -0.873 . . . . 0.88 108.642 178.493 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.59 -32.47 71.23 Favored 'General case' 0 N--CA 1.494 1.741 0 O-C-N 121.069 -1.019 . . . . 1.06 111.732 -179.651 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.8 mm-40 -64.25 -30.05 71.12 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.082 -1.011 . . . . 1.61 109.321 -179.668 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.7 tttt -60.42 -35.47 75.86 Favored 'General case' 0 C--N 1.296 -1.728 0 N-CA-C 109.301 -0.629 . . . . 1.45 109.301 -179.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.764 HD21 ' CD1' ' A' ' 77' ' ' PHE . 55.0 mt -59.79 -39.87 86.41 Favored 'General case' 0 C--N 1.301 -1.51 0 CA-C-O 122.145 0.974 . . . . 0.19 108.797 179.337 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.7 tt0 -63.24 -40.43 97.41 Favored 'General case' 0 C--N 1.296 -1.746 0 C-N-CA 119.967 -0.693 . . . . 2.1 110.755 -178.053 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.19 -44.3 72.45 Favored 'General case' 0 C--N 1.299 -1.601 0 O-C-N 121.078 -1.013 . . . . 0.19 111.754 -178.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.0 m -67.11 -38.55 85.8 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.771 -1.205 . . . . 0.2 109.819 -178.635 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.7 mt -60.91 -49.93 82.64 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.755 0 O-C-N 121.187 -0.946 . . . . 0.16 108.494 179.612 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . . . . . . . . . 25.0 t-20 -60.01 -36.38 77.08 Favored 'General case' 0 C--N 1.301 -1.54 0 CA-C-O 122.055 0.931 . . . . 0.95 109.074 179.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 3.6 tm-20 -67.2 -40.16 86.45 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.732 -0.605 . . . . 2.21 110.38 -178.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . . . . . . . . . 57.3 mt -99.36 -4.7 31.05 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.12 -0.988 . . . . 0.25 111.225 -178.669 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . . . . . . . . . 6.1 p . . . . . 0 N--CA 1.497 1.901 0 O-C-N 120.207 -1.558 . . . . 1.08 109.366 -178.71 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 48.6 Cg_exo . . . . . 0 N--CA 1.493 1.468 0 CA-C-O 121.002 0.334 . . . . 1.46 112.605 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.1 124.38 33.18 Favored 'General case' 0 N--CA 1.496 1.825 0 O-C-N 120.848 -1.158 . . . . 0.88 108.937 179.243 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.44 HG22 ' H ' ' B' ' 63' ' ' LYS . 24.8 m -109.96 129.9 55.6 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 121.298 -0.876 . . . . 0.7 109.153 179.997 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.4 mt -63.83 -30.38 71.48 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.221 -0.924 . . . . 0.61 109.454 179.952 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.44 ' H ' HG22 ' B' ' 61' ' ' THR . 41.4 mmtm -59.49 -27.02 65.76 Favored 'General case' 0 C--N 1.3 -1.547 0 O-C-N 121.524 -0.735 . . . . 1.31 109.458 -179.275 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.44 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.8 mm -128.9 141.57 46.28 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.896 -0.503 . . . . 0.15 110.169 -179.119 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 8.5 m -101.21 128.25 47.42 Favored 'General case' 0 N--CA 1.497 1.892 0 N-CA-C 106.799 -1.556 . . . . 0.19 106.799 177.284 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.9 m -79.84 141.1 36.51 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.759 -1.213 . . . . 0.2 110.442 -178.665 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.508 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.2 m95 -74.47 -12.23 60.44 Favored 'General case' 0 N--CA 1.49 1.534 0 O-C-N 121.217 -0.927 . . . . 0.21 109.316 -179.995 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.29 -12.1 0.13 Allowed 'General case' 0 N--CA 1.488 1.437 0 O-C-N 121.145 -0.972 . . . . 0.49 108.919 -179.982 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.454 ' N ' ' O ' ' B' ' 67' ' ' TRP . 15.6 m -60.28 141.81 16.37 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.598 0 O-C-N 121.2 -0.937 . . . . 1.04 109.739 179.769 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 32.6 m-20 -59.87 -37.52 79.56 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 121.135 -0.978 . . . . 1.36 109.462 -179.567 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.317 0 CA-C-O 117.909 -1.495 . . . . 2.32 109.761 -179.813 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 34.0 tpp . . . . . 0 N--CA 1.493 1.695 0 N-CA-C 109.46 -0.571 . . . . 2.88 109.46 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.523 HG12 ' N ' ' A' ' 3' ' ' LYS . 53.9 t -98.75 163.98 2.54 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.001 0 O-C-N 121.493 -0.755 . . . . 0.45 109.153 179.585 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.523 ' N ' HG12 ' A' ' 2' ' ' VAL . 48.3 tptt -130.8 129.89 42.98 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.486 -0.931 . . . . 1.67 108.486 -179.854 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.2 tt0 -97.41 125.1 41.84 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.227 -0.921 . . . . 0.31 108.829 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 26.9 mm -103.03 113.6 40.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 N-CA-C 108.382 -0.97 . . . . 0.19 108.382 179.37 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.475 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.6 mp0 -96.88 -0.64 47.4 Favored 'General case' 0 N--CA 1.49 1.568 0 O-C-N 121.011 -1.056 . . . . 2.25 109.843 -179.627 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.3 p -154.7 156.53 36.56 Favored 'General case' 0 N--CA 1.498 1.963 0 O-C-N 121.014 -1.054 . . . . 0.15 110.802 179.444 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.1 ttmt -63.62 -31.95 73.27 Favored 'General case' 0 N--CA 1.49 1.564 0 N-CA-C 108.289 -1.004 . . . . 1.65 108.289 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.451 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 59.3 m -57.15 -48.21 79.25 Favored 'General case' 0 C--N 1.3 -1.555 0 C-N-CA 119.403 -0.919 . . . . 0.23 108.826 -179.047 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.36 -28.82 66.54 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.205 -0.934 . . . . 0.17 108.959 179.101 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.476 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.0 t80 -59.9 -43.94 94.55 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.323 -0.861 . . . . 0.14 109.272 -179.997 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.1 mm100 -65.59 -42.55 91.57 Favored 'General case' 0 C--N 1.294 -1.824 0 C-N-CA 119.823 -0.751 . . . . 1.31 109.052 -179.746 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.55 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -63.67 -40.05 95.86 Favored 'General case' 0 N--CA 1.493 1.689 0 O-C-N 121.732 -0.605 . . . . 1.77 110.394 179.71 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.1 -41.24 90.86 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.137 -0.977 . . . . 0.15 109.239 -179.13 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.476 HD11 ' CE2' ' A' ' 11' ' ' PHE . 80.6 mt -59.99 -40.02 87.72 Favored 'General case' 0 C--N 1.301 -1.533 0 N-CA-C 108.222 -1.029 . . . . 0.17 108.222 179.828 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 47.7 t0 -70.07 -35.31 74.13 Favored 'General case' 0 C--N 1.304 -1.396 0 C-N-CA 119.926 -0.71 . . . . 1.07 110.127 -179.831 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.05 -36.65 77.93 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.095 -1.003 . . . . 0.18 110.001 -179.361 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.32 -34.76 77.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 120.918 -1.114 . . . . 0.17 109.507 179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.37 -124.52 19.2 Favored Glycine 0 N--CA 1.492 2.413 0 N-CA-C 110.125 -1.19 . . . . 0.2 110.125 179.918 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.7 m-20 -91.92 5.2 50.97 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 120.943 -1.328 . . . . 1.07 110.307 -178.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 57.7 mttp -77.29 149.33 35.38 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.004 -1.06 . . . . 1.5 109.021 179.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.681 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -61.2 156.49 18.31 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 107.614 -1.254 . . . . 0.47 107.614 -179.979 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.647 ' H ' HD23 ' A' ' 22' ' ' LEU . 84.5 t -143.78 113.04 1.96 Allowed 'Isoleucine or valine' 0 N--CA 1.493 1.699 0 O-C-N 120.807 -1.183 . . . . 0.17 109.205 179.964 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 30.3 t -101.22 142.39 16.07 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.895 0 N-CA-C 108.392 -0.966 . . . . 0.14 108.392 179.591 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 25.4 t -125.42 121.96 61.57 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.341 0 O-C-N 121.218 -0.926 . . . . 0.13 109.582 -178.994 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 64.5 t0 -98.82 120.9 40.04 Favored 'General case' 0 N--CA 1.499 2.022 0 O-C-N 121.355 -0.841 . . . . 1.05 110.346 179.866 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 56.7 m-85 -95.94 24.43 5.5 Favored 'General case' 0 N--CA 1.497 1.887 0 O-C-N 121.242 -0.911 . . . . 0.73 109.49 178.97 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 51.9 m -59.22 145.79 41.53 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.154 -0.966 . . . . 0.3 110.545 -178.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.654 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.21 123.3 31.33 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 108.406 -0.961 . . . . 0.22 108.406 179.478 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.3 t -67.91 -30.96 70.42 Favored 'General case' 0 C--N 1.294 -1.814 0 N-CA-C 107.91 -1.144 . . . . 0.3 107.91 179.448 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.654 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 55.8 p-90 -71.38 -26.38 62.76 Favored 'General case' 0 N--CA 1.495 1.798 0 O-C-N 121.373 -0.829 . . . . 0.26 110.6 179.194 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 8.6 t -83.27 123.68 29.83 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 120.803 -1.186 . . . . 0.26 107.967 179.807 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.423 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.08 -53.07 32.06 Favored Glycine 0 N--CA 1.493 2.494 0 C-N-CA 120.506 -0.854 . . . . 0.23 111.534 -178.052 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.423 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.4 Cg_exo -51.55 -31.96 41.9 Favored 'Trans proline' 0 C--N 1.31 -1.483 0 CA-C-N 118.704 1.252 . . . . 0.31 112.095 179.853 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.38 -50.67 10.48 Favored 'General case' 0 N--CA 1.488 1.434 0 O-C-N 121.377 -0.827 . . . . 0.24 109.725 179.798 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.6 tttt -59.67 -39.27 83.9 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.282 -0.887 . . . . 1.59 109.468 179.92 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 49.3 ttm -57.6 -27.7 62.98 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.474 -0.766 . . . . 2.1 109.622 -179.867 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.559 HG22 ' O ' ' A' ' 38' ' ' ILE . 66.3 mt -85.29 -2.99 7.96 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.859 0 O-C-N 121.607 -0.683 . . . . 0.49 111.374 -178.839 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.35 -30.13 6.22 Favored Pre-proline 0 N--CA 1.496 1.833 0 O-C-N 120.447 -1.408 . . . . 0.8 113.454 -179.289 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 33.8 Cg_exo -59.28 -41.62 57.47 Favored 'Trans proline' 0 N--CA 1.491 1.379 0 CA-C-N 121.52 1.578 . . . . 0.28 113.642 -176.91 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 33.7 m-85 -67.98 -45.27 74.59 Favored 'General case' 0 N--CA 1.488 1.443 0 C-N-CA 117.589 -1.644 . . . . 0.37 107.771 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.4 t80 -59.69 -54.37 47.14 Favored 'General case' 0 C--N 1.301 -1.507 0 O-C-N 121.202 -0.936 . . . . 0.16 110.239 178.631 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.41 ' ND1' HG21 ' A' ' 2' ' ' VAL . 34.4 t60 -68.24 -40.0 82.12 Favored 'General case' 0 N--CA 1.493 1.712 0 O-C-N 121.546 -0.721 . . . . 0.32 110.866 -179.477 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.47 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.5 m -61.18 -39.03 88.61 Favored 'General case' 0 N--CA 1.497 1.92 0 O-C-N 120.823 -1.173 . . . . 0.22 110.755 -179.7 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.7 mt -61.93 -22.51 65.66 Favored 'General case' 0 N--CA 1.492 1.662 0 O-C-N 121.143 -0.973 . . . . 0.22 110.901 -178.723 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.9 m -54.12 -35.45 62.2 Favored 'General case' 0 C--N 1.299 -1.591 0 O-C-N 120.82 -1.175 . . . . 0.16 108.457 -178.922 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 mp0 -88.26 -14.78 37.55 Favored 'General case' 0 C--N 1.3 -1.583 0 O-C-N 121.485 -0.759 . . . . 2.16 108.961 179.675 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 80.6 tttt -79.34 -36.21 39.8 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 106.955 -1.498 . . . . 1.78 106.955 178.561 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.413 ' OH ' ' OE2' ' A' ' 98' ' ' GLU . 78.0 m-85 -124.82 68.83 1.1 Allowed 'General case' 0 N--CA 1.494 1.756 0 N-CA-C 107.29 -1.374 . . . . 0.25 107.29 178.088 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 71.7 p -65.11 -8.5 16.97 Favored 'General case' 0 N--CA 1.487 1.395 0 O-C-N 121.496 -0.752 . . . . 0.22 109.188 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.0 t30 -89.02 6.09 41.34 Favored 'General case' 0 N--CA 1.49 1.527 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.435 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.456 HG13 ' HB3' ' A' ' 22' ' ' LEU . 41.6 t -126.09 145.56 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.523 0 N-CA-C 107.441 -1.318 . . . . 0.24 107.441 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.1 mm -100.0 122.24 51.66 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.159 0 O-C-N 121.164 -0.96 . . . . 0.15 109.456 -178.611 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.581 ' C ' HD12 ' A' ' 55' ' ' LEU . 38.1 m-85 -103.12 125.17 49.71 Favored 'General case' 0 N--CA 1.506 2.354 0 O-C-N 121.317 -0.864 . . . . 0.12 109.549 179.711 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.581 HD12 ' C ' ' A' ' 54' ' ' PHE . 6.0 mp -110.09 142.04 42.1 Favored 'General case' 0 N--CA 1.507 2.42 0 O-C-N 121.101 -0.999 . . . . 0.22 109.585 179.594 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 53.4 tt0 -109.41 132.33 54.23 Favored 'General case' 0 N--CA 1.497 1.877 0 N-CA-C 106.897 -1.52 . . . . 1.13 106.897 178.405 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 44.2 t -130.28 134.17 62.93 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.205 0 O-C-N 121.231 -0.918 . . . . 0.15 110.856 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.516 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 40.8 t0 -96.35 120.85 37.39 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.564 -0.71 . . . . 1.05 109.44 179.795 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 29.4 m -67.81 -19.35 24.84 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.618 0 O-C-N 120.635 -1.29 . . . . 0.16 108.464 179.11 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.9 m-20 -92.24 -43.68 9.17 Favored 'General case' 0 N--CA 1.495 1.781 0 O-C-N 121.483 -0.761 . . . . 1.08 111.446 -179.215 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.44 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 33.4 m-20 -93.25 -21.87 19.35 Favored 'General case' 0 N--CA 1.502 2.127 0 O-C-N 120.535 -1.353 . . . . 1.07 108.355 179.914 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.516 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -117.61 38.57 3.57 Favored 'General case' 0 N--CA 1.495 1.794 0 N-CA-C 107.982 -1.118 . . . . 0.14 107.982 179.435 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 6.5 pt20 -59.83 -22.19 61.9 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.814 -0.554 . . . . 1.47 109.903 -178.757 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.601 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -63.93 -38.86 92.63 Favored 'General case' 0 C--N 1.3 -1.569 0 O-C-N 121.123 -0.986 . . . . 1.05 108.943 179.468 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.601 HG23 ' OD1' ' A' ' 64' ' ' ASP . 12.0 t -72.48 -43.98 62.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.431 0 O-C-N 121.319 -0.863 . . . . 0.35 109.952 179.759 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -40.16 75.63 Favored 'General case' 0 C--N 1.302 -1.463 0 O-C-N 121.564 -0.71 . . . . 0.26 111.118 -177.874 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.5 p -63.02 -32.69 74.11 Favored 'General case' 0 N--CA 1.49 1.559 0 O-C-N 120.909 -1.119 . . . . 0.24 108.884 -179.392 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 37.5 tt0 -63.51 -39.89 95.64 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 108.839 -0.8 . . . . 2.06 108.839 179.406 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.28 0.52 56.04 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.601 -0.687 . . . . 0.23 109.872 179.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 54.52 50.17 16.64 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.273 -0.892 . . . . 2.02 109.718 -179.576 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.0 t -63.37 131.35 28.88 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.647 0 C-N-CA 118.153 -1.419 . . . . 0.16 108.732 -178.976 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 41.8 mmtm -104.86 -10.48 17.31 Favored 'General case' 0 C--N 1.304 -1.407 0 O-C-N 121.94 -0.475 . . . . 1.6 110.15 -178.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.93 152.28 15.24 Favored 'General case' 0 N--CA 1.492 1.648 0 O-C-N 120.834 -1.166 . . . . 0.14 110.915 179.882 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -124.99 154.12 71.24 Favored Pre-proline 0 N--CA 1.5 2.07 0 N-CA-C 107.388 -1.338 . . . . 0.15 107.388 178.185 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -77.37 144.21 76.97 Favored 'Cis proline' 0 N--CA 1.487 1.107 0 C-N-CA 123.601 -1.416 . . . . 0.16 112.062 -2.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.3 m -129.96 133.87 47.08 Favored 'General case' 0 N--CA 1.492 1.674 0 N-CA-C 108.199 -1.037 . . . . 0.13 108.199 178.197 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.425 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 84.1 m-85 -112.46 132.24 55.16 Favored 'General case' 0 C--N 1.299 -1.622 0 N-CA-C 108.356 -0.979 . . . . 0.2 108.356 -179.339 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.2 mt-30 -123.15 142.79 50.51 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.285 -0.884 . . . . 0.29 108.976 -179.931 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -108.17 132.12 53.95 Favored 'General case' 0 N--CA 1.499 2.015 0 CA-C-O 121.712 0.768 . . . . 0.14 111.395 -178.855 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -125.77 145.44 50.2 Favored 'General case' 0 N--CA 1.492 1.672 0 N-CA-C 109.239 -0.652 . . . . 0.15 109.239 178.953 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 11.9 tttp -147.7 131.44 16.96 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.251 -1.389 . . . . 1.68 107.251 178.699 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 59.0 mttp 56.22 26.76 10.76 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 107.564 -1.273 . . . . 1.22 107.564 -177.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.07 17.46 79.68 Favored Glycine 0 N--CA 1.487 2.083 0 N-CA-C 110.354 -1.098 . . . . 0.23 110.354 179.913 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.442 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.7 mm-40 -117.93 136.71 53.31 Favored 'General case' 0 N--CA 1.503 2.224 0 O-C-N 121.47 -1.018 . . . . 2.07 109.869 179.899 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 64.3 tttm -79.41 122.21 26.13 Favored 'General case' 0 N--CA 1.496 1.827 0 O-C-N 121.119 -0.988 . . . . 1.82 108.457 178.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 19.0 m -122.82 11.88 5.5 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.91 0 O-C-N 121.595 -0.691 . . . . 0.3 111.304 -178.527 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.26 155.46 15.99 Favored Glycine 0 N--CA 1.496 2.694 0 C-N-CA 118.589 -1.767 . . . . 0.17 111.254 -179.987 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.512 ' CD ' ' N ' ' A' ' 89' ' ' PHE . 2.3 tp10 -165.54 148.18 7.73 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.809 -0.818 . . . . 1.93 109.478 -179.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.512 ' N ' ' CD ' ' A' ' 88' ' ' GLU . 6.8 p90 -167.05 159.03 12.77 Favored 'General case' 0 N--CA 1.494 1.758 0 O-C-N 121.353 -0.842 . . . . 0.14 110.05 177.31 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.5 p -127.08 161.41 28.5 Favored 'General case' 0 N--CA 1.495 1.824 0 O-C-N 121.647 -0.658 . . . . 0.12 109.486 179.98 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.508 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.77 141.71 6.15 Favored Glycine 0 N--CA 1.49 2.294 0 N-CA-C 108.995 -1.642 . . . . 0.12 108.995 179.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.511 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -80.16 67.12 5.87 Favored 'General case' 0 C--N 1.298 -1.639 0 O-C-N 121.391 -1.064 . . . . 0.18 110.078 -179.502 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.46 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.1 t-20 -120.25 99.37 6.55 Favored 'General case' 0 N--CA 1.497 1.92 0 N-CA-C 108.355 -0.98 . . . . 0.88 108.355 178.358 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.493 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -67.82 -32.25 72.67 Favored 'General case' 0 N--CA 1.491 1.609 0 O-C-N 121.273 -0.892 . . . . 1.06 111.726 -178.822 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.6 mm-40 -65.97 -28.07 68.63 Favored 'General case' 0 N--CA 1.489 1.509 0 O-C-N 120.594 -1.317 . . . . 1.61 109.643 179.724 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.46 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 21.6 ttmt -61.0 -35.26 76.37 Favored 'General case' 0 N--CA 1.492 1.625 0 N-CA-C 108.779 -0.822 . . . . 1.45 108.779 -179.383 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 75.1 mt -59.64 -38.83 82.44 Favored 'General case' 0 C--N 1.3 -1.565 0 CA-C-O 122.101 0.953 . . . . 0.19 108.949 179.431 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . 0.413 ' OE2' ' OH ' ' A' ' 49' ' ' TYR . 9.6 tp10 -63.23 -43.52 97.83 Favored 'General case' 0 C--N 1.293 -1.889 0 C-N-CA 120.109 -0.637 . . . . 2.1 111.53 -177.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.11 -43.64 77.98 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 120.988 -1.07 . . . . 0.19 111.613 -178.425 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.08 -40.13 94.18 Favored 'General case' 0 N--CA 1.49 1.571 0 O-C-N 120.739 -1.226 . . . . 0.2 109.739 -178.28 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.0 mt -60.05 -50.02 81.79 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.155 -1.054 . . . . 0.16 108.155 179.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.477 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.9 t-20 -59.7 -35.3 74.23 Favored 'General case' 0 C--N 1.299 -1.59 0 CA-C-O 122.041 0.924 . . . . 0.95 108.588 178.811 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -67.89 -39.84 83.59 Favored 'General case' 0 C--N 1.302 -1.473 0 O-C-N 121.532 -0.73 . . . . 2.21 109.971 -178.997 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.681 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.8 mt -99.99 -0.89 38.42 Favored 'General case' 0 N--CA 1.502 2.155 0 O-C-N 121.214 -0.929 . . . . 0.25 111.273 -179.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.477 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.7 p . . . . . 0 N--CA 1.498 1.936 0 O-C-N 120.481 -1.387 . . . . 1.08 109.265 -179.599 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo . . . . . 0 N--CA 1.495 1.593 0 CA-C-O 121.106 0.378 . . . . 1.46 112.611 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -96.27 124.98 40.47 Favored 'General case' 0 N--CA 1.494 1.772 0 O-C-N 121.208 -0.933 . . . . 0.88 109.189 179.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.433 HG22 ' H ' ' B' ' 63' ' ' LYS . 27.5 m -112.34 130.64 55.89 Favored 'General case' 0 N--CA 1.5 2.071 0 O-C-N 121.53 -0.732 . . . . 0.7 109.529 -179.463 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 88.1 mt -67.46 -28.65 68.05 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.359 -0.838 . . . . 0.61 109.883 -179.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.433 ' H ' HG22 ' B' ' 61' ' ' THR . 68.3 mmtt -59.05 -26.83 64.95 Favored 'General case' 0 N--CA 1.497 1.899 0 O-C-N 120.923 -1.111 . . . . 1.31 109.559 -179.39 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.508 HD11 ' HA2' ' A' ' 91' ' ' GLY . 38.3 mm -128.77 141.05 47.6 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.505 0 N-CA-C 109.541 -0.54 . . . . 0.15 109.541 179.764 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 34.7 m -98.47 127.27 44.33 Favored 'General case' 0 N--CA 1.496 1.834 0 N-CA-C 106.837 -1.542 . . . . 0.19 106.837 177.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.3 m -77.54 139.36 39.56 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 120.688 -1.258 . . . . 0.2 110.738 -178.289 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.472 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 21.1 m95 -74.52 -10.9 60.01 Favored 'General case' 0 N--CA 1.494 1.74 0 O-C-N 121.122 -0.987 . . . . 0.21 109.253 179.202 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -51.64 -12.23 0.17 Allowed 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.425 -0.797 . . . . 0.49 109.16 179.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.456 ' N ' ' C ' ' B' ' 67' ' ' TRP . 11.4 m -59.46 136.54 22.96 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.567 0 O-C-N 121.22 -0.925 . . . . 1.04 110.204 -179.429 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 35.4 m-20 -59.85 -40.12 87.52 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.258 -0.901 . . . . 1.36 109.343 -179.933 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.231 0 N-CA-C 109.513 -1.435 . . . . 2.32 109.513 -179.745 . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 80.6 mmm . . . . . 0 N--CA 1.491 1.612 0 N-CA-C 109.062 -0.718 . . . . 2.88 109.062 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 74.0 t -100.1 148.58 6.54 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.246 0 O-C-N 121.178 -0.951 . . . . 0.45 109.757 -179.479 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -130.4 130.03 43.82 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.881 -0.785 . . . . 1.67 108.881 -179.785 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.7 tt0 -94.71 126.16 39.84 Favored 'General case' 0 N--CA 1.493 1.704 0 N-CA-C 106.898 -1.519 . . . . 0.31 106.898 178.074 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 34.9 mm -100.19 115.62 41.81 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.554 0 O-C-N 121.341 -0.85 . . . . 0.19 108.743 -179.786 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.2 mm-40 -98.55 -1.61 40.69 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.284 -0.885 . . . . 2.25 110.091 179.946 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -153.52 157.45 39.81 Favored 'General case' 0 N--CA 1.499 1.99 0 O-C-N 121.024 -1.048 . . . . 0.15 111.273 179.982 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.536 ' N ' ' OD2' ' A' ' 64' ' ' ASP . 27.8 ttpt -66.74 -31.72 72.55 Favored 'General case' 0 N--CA 1.486 1.359 0 N-CA-C 107.729 -1.211 . . . . 1.65 107.729 178.514 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 23.8 m -56.31 -48.11 77.36 Favored 'General case' 0 C--N 1.305 -1.326 0 N-CA-C 108.703 -0.851 . . . . 0.23 108.703 -179.353 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -71.1 -32.33 68.91 Favored 'General case' 0 C--N 1.301 -1.54 0 N-CA-C 108.935 -0.765 . . . . 0.17 108.935 178.791 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.547 ' CE2' HD11 ' A' ' 15' ' ' LEU . 53.8 t80 -57.02 -42.86 81.17 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.282 -0.887 . . . . 0.14 108.802 -179.15 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.6 mm100 -66.01 -42.21 89.98 Favored 'General case' 0 C--N 1.295 -1.781 0 N-CA-C 109.024 -0.732 . . . . 1.31 109.024 179.995 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.04 -38.56 91.28 Favored 'General case' 0 N--CA 1.49 1.575 0 CA-C-O 121.201 0.525 . . . . 1.77 110.913 -179.908 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -66.48 -40.53 89.36 Favored 'General case' 0 C--N 1.301 -1.515 0 O-C-N 121.059 -1.026 . . . . 0.15 109.176 -179.361 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.547 HD11 ' CE2' ' A' ' 11' ' ' PHE . 75.0 mt -60.89 -39.98 91.3 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.412 -0.805 . . . . 0.17 109.412 179.897 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 48.4 t0 -70.24 -34.66 73.11 Favored 'General case' 0 N--CA 1.488 1.474 0 O-C-N 121.458 -0.776 . . . . 1.07 110.164 179.726 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.19 -37.2 78.0 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.335 -0.853 . . . . 0.18 110.088 -178.773 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.44 -32.41 71.34 Favored 'General case' 0 C--N 1.299 -1.608 0 O-C-N 121.279 -0.888 . . . . 0.17 109.299 -179.928 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.06 -127.25 27.21 Favored Glycine 0 N--CA 1.487 2.079 0 N-CA-C 109.197 -1.561 . . . . 0.2 109.197 -179.833 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.6 m-20 -90.79 4.08 52.64 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.109 -1.23 . . . . 1.07 110.693 -179.151 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.6 mttm -75.13 148.97 39.21 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 120.846 -1.159 . . . . 1.5 109.633 179.755 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.7 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -61.01 155.85 19.16 Favored 'General case' 0 N--CA 1.49 1.57 0 N-CA-C 107.333 -1.358 . . . . 0.47 107.333 179.591 . . . . . . . . 3 3 . 1 . 021 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.7 ' H ' HD23 ' A' ' 22' ' ' LEU . 47.3 t -145.13 121.77 4.15 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.579 0 N-CA-C 107.826 -1.175 . . . . 0.17 107.826 179.426 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 23.2 t -110.29 141.07 26.65 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.514 0 N-CA-C 108.062 -1.088 . . . . 0.14 108.062 179.871 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 40.8 t -122.51 121.38 63.49 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.05 0 O-C-N 121.337 -0.852 . . . . 0.13 109.199 -179.45 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.569 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.7 t70 -99.34 109.31 21.93 Favored 'General case' 0 N--CA 1.499 2.024 0 O-C-N 121.46 -0.775 . . . . 1.05 111.114 179.986 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 80.4 m-85 -89.88 104.66 17.2 Favored 'General case' 0 N--CA 1.492 1.658 0 N-CA-C 106.688 -1.597 . . . . 0.73 106.688 176.916 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 69.2 m -129.99 144.21 51.21 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.622 -0.881 . . . . 0.3 108.622 179.865 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.618 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -82.31 122.39 27.89 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 107.461 -1.311 . . . . 0.22 107.461 178.93 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -64.43 -33.13 75.15 Favored 'General case' 0 C--N 1.304 -1.392 0 N-CA-C 108.209 -1.034 . . . . 0.3 108.209 -179.751 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.618 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.0 p-90 -71.8 -27.25 62.8 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.414 -0.803 . . . . 0.26 110.541 179.283 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 6.3 t -82.69 115.82 21.79 Favored 'General case' 0 N--CA 1.493 1.675 0 O-C-N 120.981 -1.075 . . . . 0.26 108.549 -178.942 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.457 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.42 -51.9 54.89 Favored Glycine 0 N--CA 1.484 1.876 0 C-N-CA 120.535 -0.841 . . . . 0.23 111.329 -178.708 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.457 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -52.03 -35.48 61.54 Favored 'Trans proline' 0 C--N 1.31 -1.45 0 CA-C-N 118.689 1.245 . . . . 0.31 112.734 -179.153 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.83 -54.83 6.31 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.149 -0.969 . . . . 0.24 110.187 -179.699 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.7 tttp -61.19 -36.28 79.43 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.114 -0.991 . . . . 1.59 109.76 179.72 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 30.0 ttp -58.1 -27.39 63.65 Favored 'General case' 0 C--N 1.299 -1.625 0 O-C-N 121.26 -0.9 . . . . 2.1 109.041 -179.56 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.551 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -87.52 -9.19 11.03 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.686 0 N-CA-C 112.178 0.436 . . . . 0.49 112.178 -179.099 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.544 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 30.1 pttt -68.2 -30.45 2.66 Favored Pre-proline 0 N--CA 1.496 1.844 0 O-C-N 119.965 -1.709 . . . . 0.8 113.437 -177.545 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.544 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 31.6 Cg_exo -49.83 -37.55 45.63 Favored 'Trans proline' 0 N--CA 1.491 1.33 0 CA-C-N 121.843 1.694 . . . . 0.28 112.826 -178.54 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 35.8 m-85 -68.09 -42.88 79.67 Favored 'General case' 0 C--N 1.303 -1.451 0 C-N-CA 117.359 -1.736 . . . . 0.37 106.857 178.35 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 82.4 t80 -61.13 -53.64 54.54 Favored 'General case' 0 C--N 1.304 -1.373 0 O-C-N 121.349 -0.844 . . . . 0.16 109.815 178.358 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 34.5 t60 -67.73 -40.4 84.19 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.329 -0.857 . . . . 0.32 110.78 -179.622 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.409 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 71.2 m -60.44 -39.92 89.24 Favored 'General case' 0 N--CA 1.499 2.014 0 O-C-N 121.117 -0.989 . . . . 0.22 111.442 -179.611 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 22.6 mt -63.91 -20.2 65.67 Favored 'General case' 0 N--CA 1.499 1.998 0 O-C-N 121.093 -1.004 . . . . 0.22 110.88 -177.986 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 51.7 m -51.28 -39.86 57.69 Favored 'General case' 0 N--CA 1.491 1.577 0 O-C-N 120.851 -1.156 . . . . 0.16 109.211 -178.559 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.3 mm-40 -81.33 -17.44 49.16 Favored 'General case' 0 C--N 1.298 -1.671 0 O-C-N 121.246 -0.909 . . . . 2.16 109.588 179.484 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 38.8 ttmt -76.87 -38.4 53.72 Favored 'General case' 0 N--CA 1.494 1.774 0 N-CA-C 107.273 -1.38 . . . . 1.78 107.273 179.953 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.3 m-85 -121.21 68.72 0.89 Allowed 'General case' 0 N--CA 1.492 1.671 0 N-CA-C 106.298 -1.742 . . . . 0.25 106.298 177.672 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 83.4 p -63.11 -9.02 9.03 Favored 'General case' 0 C--N 1.302 -1.464 0 N-CA-C 108.707 -0.849 . . . . 0.22 108.707 -179.566 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.7 t30 -91.14 8.53 35.18 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.684 -0.635 . . . . 1.13 109.433 179.86 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 22' ' ' LEU . 49.4 t -126.86 147.02 31.81 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.571 0 N-CA-C 107.849 -1.167 . . . . 0.24 107.849 179.284 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.2 mm -99.53 120.96 49.61 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.098 0 O-C-N 120.987 -1.071 . . . . 0.15 109.794 -178.422 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.561 ' C ' HD12 ' A' ' 55' ' ' LEU . 57.1 m-85 -102.9 123.89 47.38 Favored 'General case' 0 N--CA 1.504 2.27 0 O-C-N 121.38 -0.825 . . . . 0.12 109.728 179.714 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.561 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.1 mp -111.73 142.06 44.55 Favored 'General case' 0 N--CA 1.511 2.603 0 O-C-N 121.038 -1.039 . . . . 0.22 110.225 178.633 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.6 tt0 -110.34 133.04 53.64 Favored 'General case' 0 N--CA 1.493 1.687 0 N-CA-C 107.498 -1.297 . . . . 1.13 107.498 177.868 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 45.8 t -128.99 139.05 52.93 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.312 -0.868 . . . . 0.15 111.604 -178.149 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.613 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.1 t0 -102.28 120.04 39.81 Favored 'General case' 0 N--CA 1.498 1.936 0 N-CA-C 109.135 -0.691 . . . . 1.05 109.135 179.433 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.4 m -68.13 -18.65 23.76 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.604 0 O-C-N 120.797 -1.189 . . . . 0.16 108.471 178.823 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . . . . . . . . . 2.1 m-20 -92.37 -41.53 10.29 Favored 'General case' 0 N--CA 1.494 1.755 0 O-C-N 121.387 -0.821 . . . . 1.08 111.608 -178.736 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 61.2 m-20 -95.93 -15.05 22.62 Favored 'General case' 0 N--CA 1.506 2.327 0 O-C-N 120.602 -1.311 . . . . 1.07 108.122 179.085 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.613 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.64 39.69 3.92 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.228 -1.397 . . . . 0.14 107.228 179.031 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 24.8 pt20 -60.98 -20.1 61.95 Favored 'General case' 0 C--N 1.301 -1.529 0 CA-C-O 121.307 0.575 . . . . 1.47 109.48 -178.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.536 ' OD2' ' N ' ' A' ' 8' ' ' LYS . 5.0 p-10 -67.4 -39.95 85.6 Favored 'General case' 0 N--CA 1.492 1.632 0 O-C-N 121.261 -0.899 . . . . 1.05 109.653 179.505 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 4.8 t -73.13 -42.55 58.72 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.563 0 CA-C-O 121.659 0.743 . . . . 0.35 109.655 -179.748 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -39.97 72.62 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.491 -0.756 . . . . 0.26 110.431 -179.39 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 98.7 p -60.46 -35.77 76.67 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.096 -1.003 . . . . 0.24 108.766 -179.537 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 67.0 tt0 -62.41 -39.88 94.7 Favored 'General case' 0 C--N 1.302 -1.462 0 O-C-N 121.509 -0.745 . . . . 2.06 109.393 179.547 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.06 -1.73 57.65 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.276 -0.89 . . . . 0.23 111.164 -178.878 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 34.3 mp0 54.85 50.02 16.56 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.078 -1.014 . . . . 2.02 109.391 -179.766 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.3 t -66.79 131.54 32.46 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.491 0 O-C-N 120.881 -1.137 . . . . 0.16 109.188 -178.931 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.5 mmtt -103.95 -10.77 17.88 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.626 -0.672 . . . . 1.6 110.23 -179.534 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.58 ' HB1' ' CG2' ' B' ' 64' ' ' ILE . . . -162.24 155.32 20.24 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 120.829 -1.169 . . . . 0.14 110.434 -179.543 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -130.1 153.86 81.18 Favored Pre-proline 0 N--CA 1.501 2.077 0 N-CA-C 107.818 -1.178 . . . . 0.15 107.818 179.017 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -75.66 142.56 74.39 Favored 'Cis proline' 0 N--CA 1.496 1.624 0 C-N-CA 123.73 -1.363 . . . . 0.16 113.192 -2.273 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.443 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -125.71 132.25 52.42 Favored 'General case' 0 N--CA 1.495 1.807 0 N-CA-C 108.147 -1.057 . . . . 0.13 108.147 177.602 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.569 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 89.0 m-85 -108.2 130.64 55.13 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.742 -0.836 . . . . 0.2 108.742 -179.261 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.9 mt-30 -122.38 141.25 51.77 Favored 'General case' 0 N--CA 1.499 1.989 0 N-CA-C 108.135 -1.061 . . . . 0.29 108.135 179.438 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 68.7 m-85 -108.66 132.41 53.94 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.559 0.695 . . . . 0.14 110.643 -178.818 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 81.9 m-85 -125.95 146.01 50.04 Favored 'General case' 0 N--CA 1.491 1.599 0 CA-C-O 121.497 0.665 . . . . 0.15 109.925 179.88 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 55.9 tttm -149.59 131.14 14.85 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 107.975 -1.12 . . . . 1.68 107.975 179.062 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 77.4 mttt 57.34 27.52 13.9 Favored 'General case' 0 N--CA 1.498 1.954 0 N-CA-C 108.467 -0.938 . . . . 1.22 108.467 -178.905 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.96 21.47 76.22 Favored Glycine 0 N--CA 1.488 2.118 0 N-CA-C 109.887 -1.285 . . . . 0.23 109.887 -179.753 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.6 mt-30 -127.79 142.68 51.24 Favored 'General case' 0 N--CA 1.501 2.111 0 O-C-N 121.345 -1.091 . . . . 2.07 110.043 -179.941 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.447 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 76.3 tttt -79.96 129.79 34.77 Favored 'General case' 0 N--CA 1.501 2.078 0 O-C-N 121.014 -1.054 . . . . 1.82 109.166 179.665 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.4 m -123.01 4.6 5.53 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.854 0 O-C-N 121.637 -0.665 . . . . 0.3 110.741 -179.166 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 173.84 161.03 23.25 Favored Glycine 0 N--CA 1.495 2.577 0 C-N-CA 118.218 -1.944 . . . . 0.17 111.844 179.634 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.447 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 58.2 tt0 -163.9 151.88 12.88 Favored 'General case' 0 N--CA 1.487 1.418 0 O-C-N 121.714 -0.874 . . . . 1.93 109.479 179.04 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.473 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 6.7 p90 -166.72 157.15 11.91 Favored 'General case' 0 N--CA 1.496 1.846 0 O-C-N 121.435 -0.791 . . . . 0.14 109.781 177.983 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -127.51 163.05 24.99 Favored 'General case' 0 N--CA 1.497 1.919 0 CA-C-O 121.812 0.815 . . . . 0.12 110.753 -178.606 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.477 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.63 143.96 7.15 Favored Glycine 0 N--CA 1.493 2.458 0 N-CA-C 109.208 -1.557 . . . . 0.12 109.208 179.373 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.85 67.14 2.21 Favored 'General case' 0 C--N 1.303 -1.449 0 O-C-N 121.364 -1.08 . . . . 0.18 110.403 -179.476 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -120.2 91.19 3.48 Favored 'General case' 0 N--CA 1.503 2.202 0 N-CA-C 108.455 -0.943 . . . . 0.88 108.455 178.197 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.5 -31.73 72.65 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.022 -1.048 . . . . 1.06 111.353 -179.162 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -65.29 -29.84 70.64 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 120.753 -1.217 . . . . 1.61 109.961 -179.703 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.473 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 56.1 tttm -60.32 -35.8 76.44 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.374 -0.829 . . . . 1.45 109.296 -179.399 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.43 HD21 ' CD1' ' A' ' 77' ' ' PHE . 58.0 mt -58.09 -39.24 78.1 Favored 'General case' 0 C--N 1.298 -1.639 0 N-CA-C 108.738 -0.838 . . . . 0.19 108.738 179.685 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -61.8 -43.67 98.39 Favored 'General case' 0 N--CA 1.496 1.841 0 C-N-CA 119.883 -0.727 . . . . 2.1 110.964 -178.407 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.39 -43.23 77.76 Favored 'General case' 0 N--CA 1.493 1.721 0 O-C-N 121.011 -1.055 . . . . 0.19 111.357 -178.709 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.3 m -64.63 -39.55 93.89 Favored 'General case' 0 C--N 1.3 -1.55 0 O-C-N 120.824 -1.173 . . . . 0.2 110.158 -178.285 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 66.1 mt -60.44 -48.38 88.64 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.9 0 O-C-N 121.126 -0.984 . . . . 0.16 108.428 179.168 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.452 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.6 t-20 -59.95 -37.05 78.41 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.104 0.954 . . . . 0.95 108.689 179.226 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 9.7 tm-20 -67.33 -38.81 85.51 Favored 'General case' 0 C--N 1.297 -1.68 0 O-C-N 121.79 -0.569 . . . . 2.21 110.088 -178.341 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.652 ' HB2' HD11 ' A' ' 22' ' ' LEU . 79.6 mt -100.07 -2.88 33.16 Favored 'General case' 0 N--CA 1.502 2.136 0 O-C-N 120.918 -1.114 . . . . 0.25 111.367 -179.269 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.452 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.3 p . . . . . 0 N--CA 1.496 1.845 0 O-C-N 120.48 -1.388 . . . . 1.08 109.347 -179.661 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_exo . . . . . 0 N--CA 1.496 1.647 0 CA-C-O 121.19 0.412 . . . . 1.46 112.262 . . . . . . . . . 0 0 . 1 . 021 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.76 126.82 39.16 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.051 -1.03 . . . . 0.88 108.875 179.429 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.438 HG22 ' H ' ' B' ' 63' ' ' LYS . 26.7 m -109.36 128.91 55.48 Favored 'General case' 0 N--CA 1.499 2.013 0 O-C-N 121.389 -0.82 . . . . 0.7 109.82 -179.428 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 47.9 mt -64.8 -29.81 70.79 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.487 -0.758 . . . . 0.61 109.662 -179.917 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.438 ' H ' HG22 ' B' ' 61' ' ' THR . 30.1 mmtp -59.27 -21.33 59.46 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 121.383 -0.823 . . . . 1.31 109.332 -179.515 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.58 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 30.7 mm -130.74 141.07 47.15 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.426 0 N-CA-C 109.497 -0.557 . . . . 0.15 109.497 -179.607 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 64.9 m -95.91 131.66 42.02 Favored 'General case' 0 N--CA 1.5 2.046 0 N-CA-C 107.518 -1.289 . . . . 0.19 107.518 177.828 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 61.6 m -80.18 139.32 36.83 Favored 'General case' 0 N--CA 1.499 2.023 0 O-C-N 120.811 -1.18 . . . . 0.2 111.384 -178.514 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.455 ' C ' ' N ' ' B' ' 69' ' ' VAL . 22.1 m95 -78.03 -9.46 59.14 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.061 -1.024 . . . . 0.21 108.813 178.937 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -53.8 -11.35 0.39 Allowed 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.136 -0.978 . . . . 0.49 108.525 -179.936 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.455 ' N ' ' C ' ' B' ' 67' ' ' TRP . 31.5 m -61.62 134.16 27.08 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.725 0 O-C-N 121.431 -0.793 . . . . 1.04 109.927 -179.977 . . . . . . . . 2 2 . 1 . 021 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 57.8 m-20 -60.02 -40.15 88.3 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 121.084 -1.01 . . . . 1.36 109.501 179.93 . . . . . . . . 1 1 . 1 . 021 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.281 0 N-CA-C 108.964 -1.654 . . . . 2.32 108.964 -179.389 . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 87.1 mmm . . . . . 0 N--CA 1.488 1.461 0 CA-C-O 121.168 0.508 . . . . 2.88 109.682 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.551 HG12 ' N ' ' A' ' 3' ' ' LYS . 69.5 t -99.17 163.6 2.69 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.091 0 O-C-N 121.557 -0.714 . . . . 0.45 110.089 -179.559 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.551 ' N ' HG12 ' A' ' 2' ' ' VAL . 27.1 tptp -129.98 125.09 34.54 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 108.185 -1.042 . . . . 1.67 108.185 179.396 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 65.6 tt0 -95.06 123.75 38.72 Favored 'General case' 0 N--CA 1.495 1.805 0 O-C-N 121.008 -1.058 . . . . 0.31 109.027 179.788 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.87 111.97 32.25 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.588 0 N-CA-C 108.513 -0.921 . . . . 0.19 108.513 179.509 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.1 mm-40 -96.64 -0.2 48.87 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.168 -0.957 . . . . 2.25 110.212 -179.355 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -155.43 156.89 36.11 Favored 'General case' 0 N--CA 1.498 1.937 0 O-C-N 120.787 -1.196 . . . . 0.15 110.803 179.907 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.457 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 33.5 ttmt -64.04 -32.76 74.42 Favored 'General case' 0 N--CA 1.492 1.628 0 N-CA-C 107.8 -1.185 . . . . 1.65 107.8 177.866 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 58.9 m -56.13 -48.34 76.43 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 119.425 -0.91 . . . . 0.23 108.963 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.55 -31.36 70.52 Favored 'General case' 0 N--CA 1.495 1.775 0 O-C-N 121.247 -0.908 . . . . 0.17 109.28 178.719 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.498 ' CE2' HD11 ' A' ' 15' ' ' LEU . 54.2 t80 -58.99 -44.66 91.66 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.215 -0.928 . . . . 0.14 109.549 -178.906 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 96.6 mm-40 -64.11 -40.99 97.4 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 108.202 -1.036 . . . . 1.31 108.202 179.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.6 mm-40 -65.15 -36.7 85.06 Favored 'General case' 0 N--CA 1.495 1.784 0 CA-C-O 121.562 0.696 . . . . 1.77 110.344 179.401 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.79 -43.84 78.76 Favored 'General case' 0 C--N 1.299 -1.602 0 N-CA-C 108.795 -0.817 . . . . 0.15 108.795 -179.092 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.498 HD11 ' CE2' ' A' ' 11' ' ' PHE . 89.6 mt -60.67 -39.5 88.65 Favored 'General case' 0 C--N 1.302 -1.496 0 N-CA-C 108.376 -0.972 . . . . 0.17 108.376 178.914 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.5 t70 -69.01 -32.96 72.88 Favored 'General case' 0 N--CA 1.489 1.519 0 O-C-N 121.428 -0.795 . . . . 1.07 109.962 179.913 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -74.28 -36.2 63.78 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.13 -0.981 . . . . 0.18 110.539 -179.211 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.52 -30.08 70.41 Favored 'General case' 0 N--CA 1.493 1.708 0 O-C-N 121.05 -1.031 . . . . 0.17 109.555 -179.682 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.9 -127.37 24.96 Favored Glycine 0 N--CA 1.487 2.089 0 N-CA-C 110.08 -1.208 . . . . 0.2 110.08 -179.895 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -92.78 4.24 54.17 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.362 -1.081 . . . . 1.07 110.44 -179.139 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 59.5 mttp -75.45 151.33 38.08 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.172 -0.955 . . . . 1.5 109.388 -179.916 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.677 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -61.3 156.03 19.78 Favored 'General case' 0 N--CA 1.485 1.315 0 N-CA-C 107.54 -1.282 . . . . 0.47 107.54 -179.732 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.634 ' H ' HD23 ' A' ' 22' ' ' LEU . 60.7 t -142.69 119.57 6.25 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.481 0 O-C-N 121.064 -1.023 . . . . 0.17 108.469 179.643 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.9 t -105.89 139.82 25.91 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.549 0 N-CA-C 107.72 -1.215 . . . . 0.14 107.72 179.424 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 32.9 t -123.58 120.3 59.61 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.164 0 O-C-N 121.151 -0.968 . . . . 0.13 109.295 -179.25 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.7 t0 -98.53 118.51 35.39 Favored 'General case' 0 N--CA 1.498 1.951 0 O-C-N 121.375 -0.828 . . . . 1.05 110.079 179.632 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 61.2 m-85 -94.63 24.83 4.34 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.09 -1.007 . . . . 0.73 109.803 179.16 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.408 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.8 m -60.16 147.69 38.86 Favored 'General case' 0 C--N 1.299 -1.615 0 O-C-N 121.01 -1.056 . . . . 0.3 110.618 -179.011 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.774 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.83 124.0 31.09 Favored 'General case' 0 C--N 1.304 -1.379 0 N-CA-C 107.602 -1.259 . . . . 0.22 107.602 178.81 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 6.4 t -66.96 -29.2 68.99 Favored 'General case' 0 C--N 1.295 -1.796 0 N-CA-C 108.098 -1.075 . . . . 0.3 108.098 179.694 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.774 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 63.9 p-90 -75.53 -19.09 59.56 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.521 -0.737 . . . . 0.26 110.435 -179.988 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.424 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 7.0 t -87.29 111.7 21.31 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.668 -1.234 . . . . 0.26 107.668 179.971 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.71 -50.93 62.42 Favored Glycine 0 N--CA 1.486 1.992 0 C-N-CA 120.557 -0.83 . . . . 0.23 111.379 -178.13 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.458 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.78 -35.94 50.07 Favored 'Trans proline' 0 C--N 1.309 -1.514 0 CA-C-N 118.964 1.382 . . . . 0.31 111.234 -179.75 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.408 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.54 -45.11 22.64 Favored 'General case' 0 N--CA 1.49 1.554 0 O-C-N 121.378 -0.826 . . . . 0.24 109.826 179.222 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 61.2 tttm -59.95 -31.34 69.78 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.162 -0.961 . . . . 1.59 108.841 179.621 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.521 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.2 tmm? -60.37 -29.59 69.03 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.582 -0.699 . . . . 2.1 109.642 179.928 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.465 HD11 ' HB1' ' A' ' 92' ' ' ALA . 9.5 mt -81.12 -5.56 8.72 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.992 0 O-C-N 121.741 -0.6 . . . . 0.49 111.106 -179.434 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.552 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.42 -30.86 7.78 Favored Pre-proline 0 N--CA 1.491 1.602 0 O-C-N 119.881 -1.762 . . . . 0.8 112.971 -176.787 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.552 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.0 Cg_exo -59.72 -38.46 80.87 Favored 'Trans proline' 0 N--CA 1.489 1.246 0 CA-C-N 121.722 1.651 . . . . 0.28 112.29 -178.529 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 67.7 m-85 -71.43 -50.82 28.01 Favored 'General case' 0 C--N 1.304 -1.397 0 C-N-CA 118.412 -1.315 . . . . 0.37 108.759 179.449 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.3 t80 -59.7 -48.64 80.88 Favored 'General case' 0 N--CA 1.488 1.433 0 O-C-N 121.217 -0.927 . . . . 0.16 109.252 179.129 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 49.6 t60 -67.5 -44.74 77.75 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.681 -0.637 . . . . 0.32 110.969 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 63.4 m -62.13 -36.42 81.72 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 120.953 -1.092 . . . . 0.22 110.35 -179.886 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 31.0 mt -60.13 -26.12 66.0 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.198 -0.939 . . . . 0.22 110.477 -178.631 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 49.5 m -53.45 -41.79 66.5 Favored 'General case' 0 C--N 1.301 -1.52 0 O-C-N 120.79 -1.194 . . . . 0.16 108.428 -179.495 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.415 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 39.9 mp0 -86.06 -16.86 36.79 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.299 -0.876 . . . . 2.16 110.049 -179.669 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 2.6 tmtt? -78.03 -37.22 47.39 Favored 'General case' 0 N--CA 1.496 1.868 0 N-CA-C 106.516 -1.661 . . . . 1.78 106.516 179.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 85.1 m-85 -123.12 70.03 1.02 Allowed 'General case' 0 N--CA 1.496 1.864 0 N-CA-C 107.266 -1.383 . . . . 0.25 107.266 177.95 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 67.6 p -65.67 -7.83 17.42 Favored 'General case' 0 C--N 1.303 -1.449 0 N-CA-C 108.835 -0.802 . . . . 0.22 108.835 -179.498 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 24.0 t30 -88.47 3.9 48.47 Favored 'General case' 0 N--CA 1.494 1.742 0 N-CA-C 108.685 -0.857 . . . . 1.13 108.685 179.023 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.414 HG13 ' HB3' ' A' ' 22' ' ' LEU . 39.7 t -126.4 145.56 33.7 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.562 -1.273 . . . . 0.24 107.562 178.909 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.6 mm -98.67 121.86 49.72 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.929 0 O-C-N 121.027 -1.045 . . . . 0.15 109.574 -178.32 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.607 ' C ' HD12 ' A' ' 55' ' ' LEU . 39.9 m-85 -102.63 123.86 47.11 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.24 -0.912 . . . . 0.12 109.747 179.525 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.607 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -110.39 140.16 44.89 Favored 'General case' 0 N--CA 1.506 2.368 0 O-C-N 121.266 -0.896 . . . . 0.22 109.696 178.957 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -109.98 130.0 55.59 Favored 'General case' 0 N--CA 1.489 1.498 0 N-CA-C 106.831 -1.544 . . . . 1.13 106.831 178.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.9 136.72 59.96 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.949 0 CA-C-O 121.51 0.671 . . . . 0.15 110.474 -178.232 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.637 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.8 t0 -98.92 121.69 41.2 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.638 -0.664 . . . . 1.05 109.729 -179.836 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -68.31 -17.49 22.29 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.534 0 O-C-N 120.98 -1.075 . . . . 0.16 108.702 179.02 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.535 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 20.7 m-20 -94.48 -41.99 9.08 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.525 -0.735 . . . . 1.08 111.591 -178.901 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 45.4 m-20 -96.91 -13.86 22.16 Favored 'General case' 0 N--CA 1.508 2.443 0 O-C-N 120.644 -1.285 . . . . 1.07 108.476 179.506 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.637 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.63 37.88 4.31 Favored 'General case' 0 N--CA 1.489 1.483 0 N-CA-C 107.052 -1.462 . . . . 0.14 107.052 179.6 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.28 -21.85 62.43 Favored 'General case' 0 N--CA 1.488 1.458 0 N-CA-C 108.972 -0.751 . . . . 1.47 108.972 -178.961 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.457 ' OD1' ' N ' ' A' ' 8' ' ' LYS . 2.6 p30 -64.86 -39.64 93.87 Favored 'General case' 0 C--N 1.303 -1.448 0 O-C-N 121.134 -0.979 . . . . 1.05 108.964 179.215 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . . . . . . . . . 3.5 t -73.59 -44.13 53.78 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.429 0 O-C-N 121.394 -0.816 . . . . 0.35 109.781 -179.65 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.21 -38.27 72.03 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.381 -0.824 . . . . 0.26 110.71 -178.86 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.8 p -61.2 -32.86 72.62 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 120.998 -1.064 . . . . 0.24 109.091 -179.943 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 46.3 tt0 -64.65 -39.92 94.54 Favored 'General case' 0 N--CA 1.487 1.411 0 O-C-N 121.488 -0.757 . . . . 2.06 110.19 179.834 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.81 1.66 53.34 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.292 -0.88 . . . . 0.23 110.677 -178.647 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.4 mm-40 55.79 49.64 15.75 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.225 -0.922 . . . . 2.02 109.58 -179.538 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.1 t -64.77 130.65 30.13 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.699 0 C-N-CA 118.468 -1.293 . . . . 0.16 108.373 -179.687 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 65.7 mmtt -104.53 -10.8 17.37 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 121.628 -0.67 . . . . 1.6 109.968 -179.127 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.478 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -161.78 155.85 22.02 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.9 -1.125 . . . . 0.14 110.991 -179.996 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.9 p -129.68 156.26 79.08 Favored Pre-proline 0 N--CA 1.498 1.974 0 N-CA-C 107.819 -1.178 . . . . 0.15 107.819 179.087 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_endo -76.06 139.67 61.78 Favored 'Cis proline' 0 N--CA 1.497 1.681 0 C-N-CA 123.969 -1.263 . . . . 0.16 112.611 -2.489 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.7 m -124.43 135.63 53.41 Favored 'General case' 0 N--CA 1.497 1.905 0 N-CA-C 108.772 -0.825 . . . . 0.13 108.772 178.391 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.697 ' CD1' HD21 ' A' ' 97' ' ' LEU . 90.1 m-85 -113.12 131.75 55.71 Favored 'General case' 0 N--CA 1.493 1.713 0 N-CA-C 109.121 -0.696 . . . . 0.2 109.121 -179.572 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 68.5 mt-30 -122.09 140.09 52.93 Favored 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 108.139 -1.06 . . . . 0.29 108.139 178.985 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 81.3 m-85 -107.65 133.41 52.12 Favored 'General case' 0 C--N 1.298 -1.638 0 O-C-N 121.775 -0.578 . . . . 0.14 110.198 -179.558 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -126.23 148.65 49.43 Favored 'General case' 0 N--CA 1.488 1.453 0 N-CA-C 109.013 -0.736 . . . . 0.15 109.013 179.136 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 74.3 tttt -148.58 126.82 12.17 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 107.644 -1.243 . . . . 1.68 107.644 179.896 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.1 mttp 57.63 25.23 11.42 Favored 'General case' 0 N--CA 1.491 1.619 0 N-CA-C 107.704 -1.221 . . . . 1.22 107.704 -178.223 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 79.5 16.88 77.03 Favored Glycine 0 N--CA 1.489 2.19 0 N-CA-C 110.096 -1.202 . . . . 0.23 110.096 -179.957 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.414 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 4.7 mm-40 -116.23 135.67 53.7 Favored 'General case' 0 N--CA 1.503 2.179 0 O-C-N 121.482 -1.011 . . . . 2.07 109.964 -179.628 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.461 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 80.9 tttt -81.54 122.5 27.65 Favored 'General case' 0 N--CA 1.501 2.123 0 N-CA-C 108.307 -0.997 . . . . 1.82 108.307 178.32 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.3 m -123.29 9.87 5.25 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.697 0 O-C-N 121.648 -0.658 . . . . 0.3 110.811 -179.266 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 178.56 151.67 9.72 Favored Glycine 0 N--CA 1.499 2.885 0 C-N-CA 118.184 -1.96 . . . . 0.17 112.201 -179.79 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.461 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 67.9 tt0 -164.48 151.22 11.15 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 121.684 -0.892 . . . . 1.93 109.341 178.948 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.465 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 21.5 p90 -163.21 161.27 24.82 Favored 'General case' 0 N--CA 1.494 1.74 0 N-CA-C 108.768 -0.827 . . . . 0.14 108.768 177.423 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 77.4 p -125.92 160.05 30.97 Favored 'General case' 0 N--CA 1.5 2.057 0 CA-C-O 121.554 0.692 . . . . 0.12 110.059 -179.731 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.5 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.76 141.97 5.8 Favored Glycine 0 N--CA 1.493 2.441 0 N-CA-C 108.851 -1.699 . . . . 0.12 108.851 179.673 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.465 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.73 65.28 4.85 Favored 'General case' 0 C--N 1.299 -1.623 0 O-C-N 121.101 -1.235 . . . . 0.18 109.818 -179.553 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.502 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.9 t-20 -119.46 100.21 7.15 Favored 'General case' 0 N--CA 1.501 2.1 0 N-CA-C 108.142 -1.058 . . . . 0.88 108.142 178.538 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.443 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -68.09 -32.36 72.63 Favored 'General case' 0 C--N 1.299 -1.594 0 O-C-N 121.346 -0.846 . . . . 1.06 111.538 -179.026 . . . . . . . . 3 3 . 1 . 022 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -65.48 -29.55 70.22 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.968 -1.082 . . . . 1.61 109.812 179.872 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.502 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 78.2 tttt -60.18 -38.28 82.75 Favored 'General case' 0 C--N 1.298 -1.632 0 N-CA-C 108.982 -0.748 . . . . 1.45 108.982 -179.153 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.697 HD21 ' CD1' ' A' ' 77' ' ' PHE . 44.1 mt -57.14 -39.43 75.17 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.993 0.902 . . . . 0.19 108.743 179.431 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 79.5 tt0 -61.66 -41.99 98.29 Favored 'General case' 0 C--N 1.295 -1.8 0 C-N-CA 120.074 -0.65 . . . . 2.1 110.632 -177.989 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.41 -44.09 75.78 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.261 -0.899 . . . . 0.19 111.227 -179.095 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.2 m -66.16 -40.01 90.21 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 120.899 -1.126 . . . . 0.2 109.903 -178.445 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 53.7 mt -60.92 -49.73 83.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.726 0 N-CA-C 107.987 -1.116 . . . . 0.16 107.987 178.883 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.459 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.5 t-20 -59.95 -35.35 74.76 Favored 'General case' 0 C--N 1.302 -1.488 0 CA-C-O 121.853 0.835 . . . . 0.95 108.752 178.877 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 72.3 tt0 -67.19 -39.99 86.46 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.715 -0.616 . . . . 2.21 110.019 -178.74 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.677 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.0 mt -100.25 -1.87 35.26 Favored 'General case' 0 N--CA 1.497 1.881 0 O-C-N 121.316 -0.865 . . . . 0.25 111.206 -178.979 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.459 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.4 p . . . . . 0 N--CA 1.498 1.974 0 O-C-N 120.554 -1.341 . . . . 1.08 109.269 -179.64 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_exo . . . . . 0 N--CA 1.491 1.381 0 CA-C-O 121.372 0.488 . . . . 1.46 111.716 . . . . . . . . . 0 0 . 1 . 022 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.3 121.29 36.81 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.345 -0.847 . . . . 0.88 108.819 179.466 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 28.9 m -102.37 128.52 48.91 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.226 -0.921 . . . . 0.7 109.545 -179.589 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 66.3 mt -69.37 -30.2 68.15 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 121.316 -0.865 . . . . 0.61 109.355 179.455 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.3 mmtt -62.31 -19.46 63.32 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 121.591 -0.693 . . . . 1.31 109.539 -179.071 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.5 HD11 ' HA2' ' A' ' 91' ' ' GLY . 30.3 mm -131.72 141.86 44.58 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 121.672 -0.642 . . . . 0.15 109.527 -179.765 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 11.5 m -101.73 126.5 48.6 Favored 'General case' 0 N--CA 1.503 2.225 0 N-CA-C 107.688 -1.227 . . . . 0.19 107.688 177.649 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -76.97 144.35 38.82 Favored 'General case' 0 N--CA 1.499 1.981 0 O-C-N 120.988 -1.07 . . . . 0.2 110.813 -179.099 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.478 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.5 m95 -79.47 -17.04 55.05 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.334 -0.854 . . . . 0.21 109.44 179.409 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -56.56 -11.13 1.17 Allowed 'General case' 0 C--N 1.302 -1.477 0 N-CA-C 107.868 -1.16 . . . . 0.49 107.868 179.369 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.506 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.7 p -64.96 143.98 15.25 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.338 0 N-CA-C 109.153 -0.684 . . . . 1.04 109.153 179.739 . . . . . . . . 2 2 . 1 . 022 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 66.3 m-20 -60.15 -39.16 85.38 Favored 'General case' 0 N--CA 1.49 1.541 0 O-C-N 121.24 -0.912 . . . . 1.36 109.64 -179.607 . . . . . . . . 1 1 . 1 . 022 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . 0.506 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.49 2.27 0 CA-C-O 117.975 -1.458 . . . . 2.32 109.583 -179.857 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 98.0 mmm . . . . . 0 N--CA 1.489 1.495 0 N-CA-C 108.755 -0.832 . . . . 2.88 108.755 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.547 HG12 ' N ' ' A' ' 3' ' ' LYS . 79.3 t -98.7 163.91 2.55 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.013 0 O-C-N 121.198 -0.938 . . . . 0.45 109.327 -179.906 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.547 ' N ' HG12 ' A' ' 2' ' ' VAL . 18.4 tptp -129.45 128.69 43.43 Favored 'General case' 0 N--CA 1.496 1.874 0 N-CA-C 107.787 -1.19 . . . . 1.67 107.787 179.848 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -96.13 121.97 38.47 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.16 -0.963 . . . . 0.31 108.882 -179.635 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.2 mm -102.21 117.5 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.539 0 N-CA-C 107.793 -1.188 . . . . 0.19 107.793 179.379 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.7 mp0 -99.38 -0.75 40.36 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.921 -1.112 . . . . 2.25 109.993 -178.879 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.83 158.11 38.91 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 120.973 -1.079 . . . . 0.15 110.942 179.75 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.6 ttmt -63.1 -32.79 74.25 Favored 'General case' 0 N--CA 1.489 1.514 0 N-CA-C 108.467 -0.938 . . . . 1.65 108.467 178.759 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 88.0 m -57.65 -47.89 81.0 Favored 'General case' 0 C--N 1.307 -1.278 0 O-C-N 121.114 -0.991 . . . . 0.23 108.811 -179.484 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.18 -31.15 70.49 Favored 'General case' 0 C--N 1.299 -1.59 0 O-C-N 121.253 -0.905 . . . . 0.17 108.694 178.551 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.427 ' CE2' HD11 ' A' ' 15' ' ' LEU . 52.0 t80 -59.4 -43.86 92.91 Favored 'General case' 0 N--CA 1.49 1.544 0 O-C-N 121.206 -0.934 . . . . 0.14 108.655 179.956 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.4 mm100 -66.05 -41.81 90.33 Favored 'General case' 0 C--N 1.299 -1.593 0 N-CA-C 108.912 -0.773 . . . . 1.31 108.912 179.85 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.0 mm-40 -65.52 -35.68 81.59 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.594 -0.691 . . . . 1.77 110.307 179.723 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -69.04 -41.35 77.78 Favored 'General case' 0 C--N 1.3 -1.561 0 O-C-N 121.13 -0.982 . . . . 0.15 109.268 -179.406 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.427 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.7 mt -61.09 -39.9 91.67 Favored 'General case' 0 C--N 1.303 -1.425 0 O-C-N 121.192 -0.943 . . . . 0.17 108.549 179.705 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.17 -35.39 76.24 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.651 -0.655 . . . . 1.07 109.999 -179.789 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.54 -35.85 75.82 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.293 -0.88 . . . . 0.18 110.486 -179.142 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.65 -33.63 75.43 Favored 'General case' 0 N--CA 1.493 1.7 0 O-C-N 121.082 -1.011 . . . . 0.17 109.867 -179.72 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.07 -126.11 22.75 Favored Glycine 0 N--CA 1.488 2.148 0 N-CA-C 109.882 -1.287 . . . . 0.2 109.882 -179.669 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.9 m-20 -90.96 3.48 54.53 Favored 'General case' 0 N--CA 1.495 1.801 0 O-C-N 121.035 -1.273 . . . . 1.07 110.269 -178.886 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 71.7 mttt -75.4 150.43 38.34 Favored 'General case' 0 N--CA 1.493 1.68 0 O-C-N 120.858 -1.151 . . . . 1.5 109.111 -179.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.685 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -60.76 159.07 11.58 Favored 'General case' 0 N--CA 1.485 1.312 0 N-CA-C 107.244 -1.391 . . . . 0.47 107.244 179.573 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.677 ' H ' HD23 ' A' ' 22' ' ' LEU . 94.2 t -145.66 120.06 2.9 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.87 -1.144 . . . . 0.17 108.712 179.711 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 20.9 t -108.35 142.6 20.56 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.654 0 N-CA-C 107.955 -1.128 . . . . 0.14 107.955 179.551 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.7 118.76 54.3 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.003 0 O-C-N 121.189 -0.944 . . . . 0.13 109.157 -179.273 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.555 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 31.8 t70 -97.33 120.31 37.45 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 121.36 -0.837 . . . . 1.05 109.852 179.082 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 62.1 m-85 -96.7 24.06 6.4 Favored 'General case' 0 N--CA 1.499 2.018 0 O-C-N 121.237 -0.914 . . . . 0.73 110.024 179.802 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.8 m -57.48 141.94 45.87 Favored 'General case' 0 C--N 1.294 -1.812 0 O-C-N 121.233 -0.917 . . . . 0.3 110.55 -178.243 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.731 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -81.65 125.52 30.67 Favored 'General case' 0 C--N 1.306 -1.295 0 N-CA-C 107.671 -1.233 . . . . 0.22 107.671 179.138 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.5 t -67.72 -33.34 74.7 Favored 'General case' 0 C--N 1.295 -1.796 0 C-N-CA 118.94 -1.104 . . . . 0.3 108.342 179.913 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.731 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 67.6 p-90 -70.48 -24.23 62.82 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.63 -0.669 . . . . 0.26 110.902 179.56 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 5.9 t -83.93 123.11 29.62 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 107.565 -1.272 . . . . 0.26 107.565 -179.717 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.462 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -66.58 -51.82 39.18 Favored Glycine 0 N--CA 1.489 2.179 0 C-N-CA 120.27 -0.967 . . . . 0.23 111.235 -178.087 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.462 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -53.44 -33.87 69.12 Favored 'Trans proline' 0 C--N 1.306 -1.662 0 CA-C-N 118.524 1.162 . . . . 0.31 111.443 -179.583 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.52 -53.98 7.33 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.471 -0.768 . . . . 0.24 110.166 -179.896 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 84.5 tttt -60.08 -36.94 78.49 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.061 -1.024 . . . . 1.59 109.76 179.804 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.498 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.2 tmt? -60.15 -30.95 69.64 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.232 -0.917 . . . . 2.1 109.917 -179.11 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.587 HG22 ' O ' ' A' ' 38' ' ' ILE . 70.0 mt -81.38 -4.5 7.72 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.721 0 O-C-N 121.863 -0.523 . . . . 0.49 111.324 -179.335 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 13.1 ptmt -64.85 -28.79 3.05 Favored Pre-proline 0 N--CA 1.493 1.676 0 O-C-N 120.558 -1.339 . . . . 0.8 113.567 -177.179 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.8 Cg_exo -55.62 -39.64 89.93 Favored 'Trans proline' 0 N--CA 1.494 1.523 0 CA-C-N 121.952 1.733 . . . . 0.28 113.22 -176.316 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 36.4 m-85 -68.14 -44.61 75.67 Favored 'General case' 0 C--N 1.303 -1.421 0 C-N-CA 117.815 -1.554 . . . . 0.37 108.319 -179.996 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.0 t80 -60.33 -54.82 41.06 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.409 -0.807 . . . . 0.16 110.405 178.815 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . 0.513 ' ND1' HG21 ' A' ' 2' ' ' VAL . 41.7 t60 -67.65 -41.14 84.3 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.494 -0.754 . . . . 0.32 110.939 -179.727 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.412 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 64.1 m -62.14 -36.48 81.93 Favored 'General case' 0 N--CA 1.498 1.961 0 O-C-N 121.0 -1.063 . . . . 0.22 110.91 -179.685 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.4 mt -63.87 -19.37 65.01 Favored 'General case' 0 N--CA 1.493 1.707 0 O-C-N 121.214 -0.929 . . . . 0.22 110.04 -178.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.1 m -53.05 -39.53 63.32 Favored 'General case' 0 C--N 1.301 -1.53 0 N-CA-C 107.91 -1.144 . . . . 0.16 107.91 -179.533 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.406 ' N ' ' CD ' ' A' ' 47' ' ' GLU . 35.5 mp0 -82.96 -16.41 47.43 Favored 'General case' 0 N--CA 1.488 1.467 0 O-C-N 121.375 -0.828 . . . . 2.16 109.397 179.154 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 48.8 tptt -76.91 -39.0 52.39 Favored 'General case' 0 N--CA 1.501 2.084 0 N-CA-C 107.513 -1.292 . . . . 1.78 107.513 179.166 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 91.4 m-85 -123.7 67.81 1.03 Allowed 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 107.3 -1.37 . . . . 0.25 107.3 178.126 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 54.2 p -62.89 -9.08 8.42 Favored 'General case' 0 C--N 1.307 -1.261 0 N-CA-C 108.876 -0.787 . . . . 0.22 108.876 -179.467 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 29.9 t30 -90.13 6.91 40.52 Favored 'General case' 0 N--CA 1.492 1.634 0 N-CA-C 108.288 -1.004 . . . . 1.13 108.288 178.949 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.502 HG13 ' HB3' ' A' ' 22' ' ' LEU . 55.2 t -125.05 145.2 32.76 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.529 0 N-CA-C 108.041 -1.096 . . . . 0.24 108.041 179.42 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 25.5 mm -99.96 122.83 52.31 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.053 0 O-C-N 120.956 -1.09 . . . . 0.15 109.476 -178.549 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.603 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.7 m-85 -102.95 126.95 50.33 Favored 'General case' 0 N--CA 1.505 2.323 0 O-C-N 121.238 -0.914 . . . . 0.12 109.992 179.731 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.603 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.2 mp -111.32 139.98 46.27 Favored 'General case' 0 N--CA 1.508 2.469 0 O-C-N 121.128 -0.983 . . . . 0.22 109.717 178.861 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -110.2 130.11 55.6 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 107.086 -1.45 . . . . 1.13 107.086 178.124 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 48.2 t -127.76 136.25 60.88 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.094 0 O-C-N 121.401 -0.812 . . . . 0.15 110.533 -177.847 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.605 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.6 t0 -98.69 120.34 38.96 Favored 'General case' 0 N--CA 1.495 1.809 0 O-C-N 121.363 -0.836 . . . . 1.05 108.95 179.507 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -66.74 -18.25 23.89 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.595 0 O-C-N 120.479 -1.388 . . . . 0.16 108.209 179.36 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 18.8 m-20 -93.8 -44.0 8.34 Favored 'General case' 0 N--CA 1.495 1.811 0 O-C-N 121.279 -0.888 . . . . 1.08 111.545 -179.097 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.4 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 25.8 m-20 -93.95 -13.49 27.01 Favored 'General case' 0 N--CA 1.503 2.195 0 O-C-N 120.537 -1.352 . . . . 1.07 108.423 179.586 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.605 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -125.24 38.38 4.19 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 107.578 -1.267 . . . . 0.14 107.578 179.518 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.3 pt20 -59.9 -23.85 63.82 Favored 'General case' 0 C--N 1.298 -1.649 0 O-C-N 121.854 -0.528 . . . . 1.47 109.882 -178.567 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.612 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.0 p30 -66.49 -38.26 86.87 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 121.034 -1.041 . . . . 1.05 108.984 179.28 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.612 HG23 ' OD1' ' A' ' 64' ' ' ASP . 16.2 t -69.95 -43.96 78.99 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.409 0 O-C-N 121.308 -0.87 . . . . 0.35 109.573 179.868 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -74.19 -36.33 64.0 Favored 'General case' 0 N--CA 1.488 1.473 0 O-C-N 121.449 -0.782 . . . . 0.26 111.235 -178.595 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.2 p -60.12 -37.73 80.91 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 120.773 -1.204 . . . . 0.24 109.428 -179.41 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.2 tm-20 -63.25 -38.13 89.96 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 121.346 -0.846 . . . . 2.06 109.526 179.327 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.448 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.44 -3.63 58.91 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.448 -0.782 . . . . 0.23 110.313 -178.907 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 31.8 mp0 54.74 49.61 17.6 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.373 -0.829 . . . . 2.02 109.232 -179.584 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 42.0 t -64.77 132.21 30.59 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 O-C-N 120.846 -1.159 . . . . 0.16 108.576 -179.238 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 52.4 mttp -103.48 -11.92 17.49 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.582 -0.699 . . . . 1.6 110.813 -178.902 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.517 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -160.97 156.26 24.53 Favored 'General case' 0 N--CA 1.497 1.885 0 O-C-N 120.751 -1.218 . . . . 0.14 110.596 -179.442 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.0 p -128.5 153.36 79.31 Favored Pre-proline 0 N--CA 1.497 1.888 0 N-CA-C 107.455 -1.313 . . . . 0.15 107.455 178.139 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.8 Cg_endo -76.85 140.47 65.27 Favored 'Cis proline' 0 N--CA 1.488 1.205 0 C-N-CA 123.617 -1.409 . . . . 0.16 112.405 -2.655 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.517 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.0 m -124.91 132.64 53.27 Favored 'General case' 0 N--CA 1.496 1.836 0 N-CA-C 107.934 -1.136 . . . . 0.13 107.934 177.475 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.555 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.0 m-85 -111.13 132.02 54.63 Favored 'General case' 0 N--CA 1.493 1.716 0 N-CA-C 108.444 -0.947 . . . . 0.2 108.444 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.448 HE22 ' HB1' ' A' ' 69' ' ' ALA . 83.4 mt-30 -122.23 143.12 49.78 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.275 -0.89 . . . . 0.29 108.612 179.463 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 100' ' ' THR . 88.2 m-85 -109.12 132.68 53.89 Favored 'General case' 0 C--N 1.3 -1.551 0 CA-C-O 121.525 0.679 . . . . 0.14 110.581 -178.589 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -127.53 147.29 50.32 Favored 'General case' 0 N--CA 1.487 1.404 0 CA-C-O 121.473 0.654 . . . . 0.15 109.341 179.194 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 73.3 tttt -148.9 126.35 11.6 Favored 'General case' 0 C--N 1.302 -1.466 0 N-CA-C 107.74 -1.207 . . . . 1.68 107.74 179.349 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.3 mttp 59.86 28.42 17.91 Favored 'General case' 0 N--CA 1.496 1.858 0 O-C-N 121.518 -0.739 . . . . 1.22 109.072 -179.065 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 78.89 19.95 71.72 Favored Glycine 0 N--CA 1.489 2.198 0 O-C-N 121.101 -0.999 . . . . 0.23 111.095 179.281 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.1 mt-30 -130.46 145.13 51.78 Favored 'General case' 0 N--CA 1.501 2.114 0 O-C-N 121.045 -1.268 . . . . 2.07 109.94 179.714 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.0 ttpt -79.87 126.86 31.53 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.287 -0.883 . . . . 1.82 109.636 179.663 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.6 m -121.63 6.04 5.96 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.737 -0.602 . . . . 0.3 110.126 -179.976 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.81 157.03 21.09 Favored Glycine 0 N--CA 1.494 2.51 0 C-N-CA 118.716 -1.707 . . . . 0.17 111.454 179.989 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.453 ' OE2' ' CG2' ' A' ' 76' ' ' THR . 2.3 tp10 -164.95 147.46 8.22 Favored 'General case' 0 N--CA 1.491 1.614 0 N-CA-C 108.518 -0.919 . . . . 1.93 108.518 179.367 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.46 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 4.3 p90 -169.4 155.87 6.5 Favored 'General case' 0 N--CA 1.491 1.614 0 C-N-CA 119.665 -0.814 . . . . 0.14 109.213 177.932 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.4 p -126.17 162.77 24.62 Favored 'General case' 0 N--CA 1.498 1.971 0 O-C-N 121.688 -0.633 . . . . 0.12 110.024 -179.015 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.492 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 121.65 140.29 5.83 Favored Glycine 0 N--CA 1.492 2.383 0 N-CA-C 109.06 -1.616 . . . . 0.12 109.06 179.673 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.464 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -76.26 64.09 2.0 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.286 -1.126 . . . . 0.18 110.537 -179.296 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.454 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.3 t-20 -118.85 100.0 7.11 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.376 -0.972 . . . . 0.88 108.376 178.018 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.418 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.76 -30.12 67.62 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.328 -0.857 . . . . 1.06 111.641 -179.107 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -66.64 -29.85 69.97 Favored 'General case' 0 C--N 1.301 -1.529 0 O-C-N 120.875 -1.14 . . . . 1.61 109.76 -179.842 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.454 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 52.4 tttp -61.82 -33.92 75.01 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 109.043 -0.725 . . . . 1.45 109.043 -179.339 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 37.4 mt -59.48 -39.98 85.48 Favored 'General case' 0 C--N 1.299 -1.621 0 N-CA-C 108.707 -0.849 . . . . 0.19 108.707 179.571 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.3 tt0 -62.9 -43.96 97.38 Favored 'General case' 0 C--N 1.297 -1.707 0 C-N-CA 119.232 -0.987 . . . . 2.1 110.854 -178.363 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.06 -43.78 77.84 Favored 'General case' 0 C--N 1.3 -1.558 0 O-C-N 121.187 -0.946 . . . . 0.19 111.076 -178.362 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.4 HG21 ' CE1' ' A' ' 79' ' ' PHE . 19.6 m -64.74 -39.95 94.49 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 120.736 -1.228 . . . . 0.2 108.189 -179.104 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.429 ' O ' ' N ' ' A' ' 105' ' ' VAL . 74.1 mt -65.29 -47.13 88.41 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.803 0 N-CA-C 107.671 -1.233 . . . . 0.16 107.671 178.397 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.479 ' O ' HG12 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -60.52 -35.47 76.06 Favored 'General case' 0 C--N 1.299 -1.588 0 N-CA-C 107.657 -1.238 . . . . 0.95 107.657 179.562 . . . . . . . . 3 3 . 1 . 023 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -69.98 -39.23 76.05 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-N 116.022 -0.535 . . . . 2.21 110.143 -179.33 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.685 ' HB2' HD11 ' A' ' 22' ' ' LEU . 84.6 mt -98.34 -4.45 34.92 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 121.061 -1.025 . . . . 0.25 111.398 -178.986 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.479 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.3 p . . . . . 0 N--CA 1.498 1.933 0 O-C-N 120.485 -1.385 . . . . 1.08 109.143 -179.668 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 24.5 Cg_endo . . . . . 0 N--CA 1.492 1.399 0 CA-C-O 120.934 0.306 . . . . 1.46 112.334 . . . . . . . . . 0 0 . 1 . 023 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -105.58 122.58 46.32 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.214 -0.929 . . . . 0.88 109.397 179.327 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.483 HG22 ' H ' ' B' ' 63' ' ' LYS . 56.9 m -107.1 131.21 54.37 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.255 -0.903 . . . . 0.7 109.978 -179.4 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.2 mt -68.09 -30.21 69.33 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.269 -0.894 . . . . 0.61 109.929 179.841 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.483 ' H ' HG22 ' B' ' 61' ' ' THR . 42.2 mmtm -65.3 -16.97 64.13 Favored 'General case' 0 N--CA 1.5 2.029 0 O-C-N 121.134 -0.979 . . . . 1.31 109.578 -179.404 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.493 ' CG2' ' HB1' ' A' ' 73' ' ' ALA . 33.2 mm -130.42 142.49 43.58 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.519 0 O-C-N 121.855 -0.528 . . . . 0.15 109.721 -179.46 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 22.2 m -98.49 131.97 44.31 Favored 'General case' 0 N--CA 1.505 2.32 0 N-CA-C 107.407 -1.331 . . . . 0.19 107.407 177.57 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.4 m -81.02 139.38 35.79 Favored 'General case' 0 N--CA 1.501 2.104 0 O-C-N 120.851 -1.155 . . . . 0.2 111.244 -178.2 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.472 ' C ' ' N ' ' B' ' 69' ' ' VAL . 22.9 m95 -77.19 -18.28 57.87 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.292 -0.88 . . . . 0.21 109.409 178.882 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.474 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.8 m120 -54.11 -12.57 0.63 Allowed 'General case' 0 N--CA 1.491 1.59 0 N-CA-C 108.123 -1.066 . . . . 0.49 108.123 179.354 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.584 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.4 p -61.89 136.99 24.62 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.548 0 N-CA-C 109.13 -0.693 . . . . 1.04 109.13 -179.958 . . . . . . . . 2 2 . 1 . 023 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 51.6 m-20 -64.96 -28.23 69.38 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.01 -1.056 . . . . 1.36 109.909 -178.99 . . . . . . . . 1 1 . 1 . 023 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . 0.584 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.49 2.245 0 N-CA-C 109.292 -1.523 . . . . 2.32 109.292 -179.732 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 45.0 ttm . . . . . 0 N--CA 1.491 1.595 0 N-CA-C 109.141 -0.688 . . . . 2.88 109.141 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 96.3 t -98.88 152.8 4.28 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.017 0 O-C-N 121.231 -0.918 . . . . 0.45 109.553 -179.785 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 17.3 ttmm -129.94 123.97 31.98 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 121.432 -0.792 . . . . 1.67 109.205 179.924 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -93.37 125.16 37.82 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 108.742 -0.836 . . . . 0.31 108.742 179.721 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.1 mm -99.86 113.59 35.69 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.528 0 N-CA-C 108.422 -0.955 . . . . 0.19 108.422 179.402 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 54.5 mm-40 -99.13 -1.04 40.42 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.116 -0.99 . . . . 2.25 109.915 179.606 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 77.3 p -155.38 154.51 32.09 Favored 'General case' 0 N--CA 1.494 1.762 0 O-C-N 121.108 -0.995 . . . . 0.15 110.999 -179.855 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 13.7 ttpp -61.49 -33.96 74.68 Favored 'General case' 0 N--CA 1.489 1.493 0 N-CA-C 107.926 -1.138 . . . . 1.65 107.926 178.711 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 42.1 m -57.55 -44.12 84.95 Favored 'General case' 0 C--N 1.301 -1.503 0 C-N-CA 119.32 -0.952 . . . . 0.23 108.555 -179.446 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.45 -31.31 69.54 Favored 'General case' 0 C--N 1.301 -1.526 0 O-C-N 121.25 -0.906 . . . . 0.17 109.037 178.476 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.545 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.1 t80 -59.73 -43.2 94.28 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.257 -0.902 . . . . 0.14 109.028 -179.189 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 80.9 mm-40 -66.18 -40.52 90.53 Favored 'General case' 0 C--N 1.303 -1.456 0 N-CA-C 108.688 -0.856 . . . . 1.31 108.688 179.467 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 77.5 mm-40 -64.64 -40.93 96.32 Favored 'General case' 0 N--CA 1.493 1.717 0 CA-C-O 121.292 0.567 . . . . 1.77 110.562 179.984 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.9 -40.9 83.37 Favored 'General case' 0 C--N 1.302 -1.48 0 O-C-N 121.309 -0.869 . . . . 0.15 108.907 -178.972 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.545 HD11 ' CE2' ' A' ' 11' ' ' PHE . 58.0 mt -60.89 -40.03 91.5 Favored 'General case' 0 C--N 1.303 -1.43 0 N-CA-C 108.343 -0.984 . . . . 0.17 108.343 179.197 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 37.8 t0 -69.99 -34.37 73.25 Favored 'General case' 0 N--CA 1.488 1.454 0 O-C-N 121.416 -0.803 . . . . 1.07 109.834 179.775 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.71 -42.99 76.93 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.225 -0.922 . . . . 0.18 109.926 -179.605 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.53 -34.97 74.9 Favored 'General case' 0 C--N 1.301 -1.505 0 O-C-N 121.393 -0.817 . . . . 0.17 109.025 -179.881 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.99 -123.61 18.62 Favored Glycine 0 N--CA 1.489 2.179 0 N-CA-C 109.879 -1.288 . . . . 0.2 109.879 179.836 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 79.9 m-20 -90.19 3.3 53.86 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.133 -1.216 . . . . 1.07 110.747 -179.053 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.9 mtpt -77.06 149.99 35.76 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 1.5 109.51 -179.686 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.668 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -60.9 155.49 19.64 Favored 'General case' 0 N--CA 1.487 1.39 0 N-CA-C 108.082 -1.081 . . . . 0.47 108.082 -179.39 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.668 ' H ' HD23 ' A' ' 22' ' ' LEU . 87.6 t -144.35 112.42 1.61 Allowed 'Isoleucine or valine' 0 N--CA 1.491 1.582 0 O-C-N 121.012 -1.055 . . . . 0.17 109.131 -179.903 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -99.6 141.9 16.09 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.479 0 N-CA-C 108.168 -1.049 . . . . 0.14 108.168 179.583 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.3 t -124.98 122.34 63.11 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.295 0 O-C-N 121.217 -0.927 . . . . 0.13 110.196 -178.542 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.471 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 34.6 t70 -99.24 122.94 43.09 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 121.646 -0.658 . . . . 1.05 109.775 179.337 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 52.3 m-85 -99.26 18.54 17.33 Favored 'General case' 0 N--CA 1.503 2.194 0 O-C-N 121.264 -0.898 . . . . 0.73 109.925 179.763 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 57.5 m -52.05 147.87 6.82 Favored 'General case' 0 C--N 1.295 -1.776 0 CA-C-O 122.063 0.935 . . . . 0.3 110.618 -178.791 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.803 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.76 123.9 31.66 Favored 'General case' 0 C--N 1.301 -1.511 0 N-CA-C 107.444 -1.317 . . . . 0.22 107.444 178.743 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.9 t -66.77 -28.96 68.81 Favored 'General case' 0 C--N 1.299 -1.618 0 C-N-CA 119.195 -1.002 . . . . 0.3 108.332 -179.811 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.803 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 68.4 p-90 -78.02 -15.82 58.61 Favored 'General case' 0 N--CA 1.491 1.606 0 O-C-N 121.496 -0.753 . . . . 0.26 110.977 -179.515 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 15.7 t -88.22 116.55 26.5 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.877 -1.139 . . . . 0.26 108.04 179.547 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.42 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.37 -53.56 44.53 Favored Glycine 0 N--CA 1.489 2.193 0 C-N-CA 120.081 -1.057 . . . . 0.23 111.256 -178.521 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.42 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 35.6 Cg_exo -50.99 -35.99 52.16 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.949 1.375 . . . . 0.31 111.612 179.895 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.92 -48.81 17.14 Favored 'General case' 0 N--CA 1.488 1.464 0 O-C-N 121.438 -0.789 . . . . 0.24 109.662 -179.908 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.3 tttt -60.04 -37.81 80.92 Favored 'General case' 0 N--CA 1.494 1.764 0 O-C-N 121.099 -1.0 . . . . 1.59 109.47 179.514 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 33.0 tpp -59.12 -27.48 65.64 Favored 'General case' 0 C--N 1.302 -1.496 0 O-C-N 121.517 -0.74 . . . . 2.1 109.27 -179.393 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.594 HG22 ' O ' ' A' ' 38' ' ' ILE . 96.6 mt -80.94 -4.08 7.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.971 -0.456 . . . . 0.49 111.368 -179.772 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.536 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.91 -30.08 5.83 Favored Pre-proline 0 N--CA 1.494 1.766 0 O-C-N 120.283 -1.51 . . . . 0.8 113.916 -178.028 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.536 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 30.5 Cg_exo -58.89 -41.42 62.47 Favored 'Trans proline' 0 N--CA 1.493 1.473 0 CA-C-N 121.675 1.634 . . . . 0.28 112.379 -178.015 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . 0.634 ' CZ ' ' NZ ' ' A' ' 94' ' ' LYS . 35.4 m-85 -69.13 -50.21 50.03 Favored 'General case' 0 N--CA 1.49 1.537 0 O-C-N 120.693 -1.255 . . . . 0.37 109.547 179.513 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 93.2 t80 -59.96 -50.82 72.24 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.027 -1.045 . . . . 0.16 109.447 179.286 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 45.0 t60 -67.54 -40.01 85.02 Favored 'General case' 0 C--N 1.297 -1.717 0 O-C-N 121.891 -0.506 . . . . 0.32 110.69 -179.423 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.472 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 75.4 m -63.29 -39.22 93.97 Favored 'General case' 0 N--CA 1.499 2.0 0 O-C-N 120.957 -1.089 . . . . 0.22 111.085 -179.889 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.3 mt -60.01 -23.43 63.67 Favored 'General case' 0 C--N 1.301 -1.501 0 O-C-N 121.194 -0.941 . . . . 0.22 110.203 -178.212 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.2 m -52.0 -40.15 60.51 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 118.72 -1.192 . . . . 0.16 108.765 -179.243 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.2 mp0 -82.82 -16.68 46.77 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.454 -0.779 . . . . 2.16 109.366 179.303 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 45.1 tptt -75.68 -37.44 59.55 Favored 'General case' 0 N--CA 1.492 1.652 0 N-CA-C 107.362 -1.347 . . . . 1.78 107.362 179.388 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 95.9 m-85 -124.75 68.71 1.1 Allowed 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.077 -1.453 . . . . 0.25 107.077 177.894 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.4 p -62.28 -9.73 8.84 Favored 'General case' 0 N--CA 1.484 1.256 0 N-CA-C 108.727 -0.842 . . . . 0.22 108.727 -179.255 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.3 t30 -91.92 9.84 31.29 Favored 'General case' 0 N--CA 1.49 1.532 0 N-CA-C 108.644 -0.872 . . . . 1.13 108.644 179.046 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.453 HG13 ' HB3' ' A' ' 22' ' ' LEU . 54.8 t -127.58 144.82 36.23 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.543 0 N-CA-C 107.639 -1.245 . . . . 0.24 107.639 178.981 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.417 HG22 ' CD1' ' A' ' 55' ' ' LEU . 27.2 mm -99.99 122.34 51.76 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.933 0 O-C-N 121.269 -0.895 . . . . 0.15 109.599 -178.55 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.471 ' C ' HD12 ' A' ' 55' ' ' LEU . 48.0 m-85 -103.06 126.81 50.41 Favored 'General case' 0 N--CA 1.5 2.029 0 N-CA-C 108.692 -0.855 . . . . 0.12 108.692 179.25 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.471 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.0 mp -110.0 142.11 41.86 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.19 -0.944 . . . . 0.22 109.134 179.803 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -110.68 130.68 55.51 Favored 'General case' 0 N--CA 1.492 1.643 0 N-CA-C 106.778 -1.564 . . . . 1.13 106.778 178.073 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.3 t -127.73 131.9 69.48 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.877 0 O-C-N 121.436 -0.79 . . . . 0.15 110.113 -178.333 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.515 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 45.6 t0 -96.1 119.89 35.4 Favored 'General case' 0 N--CA 1.496 1.863 0 O-C-N 121.518 -0.739 . . . . 1.05 109.599 179.852 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 27.1 m -67.98 -14.91 18.97 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.625 0 O-C-N 120.42 -1.425 . . . . 0.16 108.658 179.438 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.546 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 14.1 m-20 -94.45 -44.07 8.07 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.425 -0.797 . . . . 1.08 111.353 -179.783 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.9 m-20 -96.75 -18.63 19.49 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 120.776 -1.202 . . . . 1.07 108.836 179.824 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.515 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -119.03 36.59 4.4 Favored 'General case' 0 N--CA 1.492 1.663 0 N-CA-C 107.346 -1.353 . . . . 0.14 107.346 179.473 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.579 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.4 OUTLIER -60.16 -23.55 64.03 Favored 'General case' 0 C--N 1.303 -1.419 0 CA-C-N 115.961 -0.563 . . . . 1.47 110.277 -178.905 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.419 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -67.09 -35.43 79.77 Favored 'General case' 0 C--N 1.302 -1.465 0 O-C-N 121.001 -1.062 . . . . 1.05 108.633 179.5 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.419 HG23 ' OD1' ' A' ' 64' ' ' ASP . 5.6 t -73.36 -43.95 55.55 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.525 0 O-C-N 121.501 -0.749 . . . . 0.35 109.158 179.376 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.27 -40.77 74.14 Favored 'General case' 0 N--CA 1.49 1.561 0 O-C-N 121.393 -0.817 . . . . 0.26 110.957 -178.819 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.7 p -61.81 -32.71 73.04 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 120.71 -1.244 . . . . 0.24 109.287 -179.636 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.3 tt0 -62.95 -38.16 89.97 Favored 'General case' 0 N--CA 1.489 1.495 0 O-C-N 121.282 -0.886 . . . . 2.06 109.075 179.344 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -89.54 2.04 55.14 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.558 -0.714 . . . . 0.23 111.081 -178.806 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.4 mp0 54.39 49.89 17.43 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 120.888 -1.133 . . . . 2.02 109.935 179.866 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 34.2 t -64.8 132.57 30.64 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.579 0 O-C-N 120.801 -1.187 . . . . 0.16 109.224 -179.114 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -103.95 -14.03 16.12 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.4 -0.812 . . . . 1.6 110.056 -179.351 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.473 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.0 157.49 21.0 Favored 'General case' 0 N--CA 1.498 1.939 0 O-C-N 120.881 -1.137 . . . . 0.14 111.031 179.913 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.5 p -128.79 155.46 79.29 Favored Pre-proline 0 N--CA 1.499 1.99 0 N-CA-C 107.326 -1.361 . . . . 0.15 107.326 178.543 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.4 Cg_endo -76.26 139.98 63.26 Favored 'Cis proline' 0 N--CA 1.49 1.288 0 C-N-CA 123.667 -1.389 . . . . 0.16 112.263 -2.178 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.473 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 99.1 m -124.56 139.53 53.79 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.491 -0.929 . . . . 0.13 108.491 178.038 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.471 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 95.4 m-85 -115.66 130.2 56.77 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 108.724 -0.843 . . . . 0.2 108.724 -179.927 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -123.45 141.86 51.58 Favored 'General case' 0 N--CA 1.495 1.785 0 N-CA-C 108.577 -0.897 . . . . 0.29 108.577 179.342 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CD1' ' N ' ' A' ' 79' ' ' PHE . 59.2 m-85 -108.37 137.25 46.65 Favored 'General case' 0 N--CA 1.491 1.619 0 CA-C-O 121.528 0.68 . . . . 0.14 110.333 -179.229 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.9 m-85 -129.91 147.31 51.66 Favored 'General case' 0 C--N 1.304 -1.407 0 CA-C-O 121.377 0.608 . . . . 0.15 109.44 179.229 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 70.8 tttt -148.05 124.31 10.87 Favored 'General case' 0 N--CA 1.488 1.459 0 N-CA-C 107.253 -1.388 . . . . 1.68 107.253 179.371 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.8 mttt 59.83 29.42 18.98 Favored 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 108.136 -1.061 . . . . 1.22 108.136 -178.235 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.4 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 76.59 15.23 81.72 Favored Glycine 0 N--CA 1.489 2.194 0 N-CA-C 109.611 -1.396 . . . . 0.23 109.611 -179.39 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.415 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 5.8 mm-40 -115.58 133.83 55.65 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 121.432 -1.04 . . . . 2.07 110.515 -179.222 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 36.0 ttpt -78.68 124.38 28.13 Favored 'General case' 0 N--CA 1.499 2.004 0 N-CA-C 108.27 -1.011 . . . . 1.82 108.27 178.217 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 29.7 m -123.93 9.14 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.903 0 O-C-N 121.558 -0.714 . . . . 0.3 110.968 -179.464 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.86 152.58 10.94 Favored Glycine 0 N--CA 1.498 2.816 0 C-N-CA 118.616 -1.754 . . . . 0.17 111.454 179.939 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.7 tm-20 -165.37 147.77 7.79 Favored 'General case' 0 N--CA 1.495 1.815 0 O-C-N 121.697 -0.884 . . . . 1.93 109.765 179.377 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 27.6 p90 -163.94 162.03 23.17 Favored 'General case' 0 N--CA 1.493 1.706 0 C-N-CA 119.305 -0.958 . . . . 0.14 109.333 177.072 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.0 p -125.4 160.36 29.61 Favored 'General case' 0 N--CA 1.496 1.86 0 CA-C-O 121.515 0.674 . . . . 0.12 109.551 -179.719 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.493 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.03 141.02 5.95 Favored Glycine 0 N--CA 1.488 2.152 0 N-CA-C 108.907 -1.677 . . . . 0.12 108.907 179.747 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.426 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.15 66.31 2.28 Favored 'General case' 0 C--N 1.297 -1.674 0 O-C-N 121.256 -1.144 . . . . 0.18 109.168 179.99 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.81 92.17 3.72 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.413 -0.804 . . . . 0.88 109.073 179.691 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.634 ' NZ ' ' CZ ' ' A' ' 41' ' ' PHE . 0.5 OUTLIER -68.08 -32.17 72.31 Favored 'General case' 0 N--CA 1.497 1.891 0 O-C-N 121.081 -1.012 . . . . 1.06 111.422 -179.791 . . . . . . . . 3 3 . 1 . 024 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.9 mm-40 -62.68 -30.13 71.17 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 120.81 -1.181 . . . . 1.61 109.075 -179.165 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -61.05 -35.66 77.53 Favored 'General case' 0 C--N 1.296 -1.734 0 N-CA-C 109.115 -0.698 . . . . 1.45 109.115 -179.931 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 78.9 mt -59.68 -39.35 84.24 Favored 'General case' 0 C--N 1.303 -1.425 0 CA-C-O 122.013 0.911 . . . . 0.19 108.892 179.697 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.5 tm-20 -61.09 -42.89 99.34 Favored 'General case' 0 C--N 1.293 -1.874 0 C-N-CA 119.846 -0.742 . . . . 2.1 110.502 -177.769 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.97 -44.02 73.77 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.252 -0.905 . . . . 0.19 111.399 -178.998 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 33.9 m -66.3 -39.87 89.61 Favored 'General case' 0 N--CA 1.49 1.531 0 O-C-N 120.903 -1.123 . . . . 0.2 110.004 -178.499 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.1 mt -61.68 -50.04 81.88 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.702 0 N-CA-C 107.819 -1.178 . . . . 0.16 107.819 178.715 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.492 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.7 t-20 -60.01 -34.91 73.99 Favored 'General case' 0 C--N 1.302 -1.473 0 N-CA-C 108.507 -0.923 . . . . 0.95 108.507 178.868 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -68.02 -40.04 83.02 Favored 'General case' 0 C--N 1.301 -1.543 0 O-C-N 121.581 -0.7 . . . . 2.21 110.368 -179.195 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.666 ' HB2' HD11 ' A' ' 22' ' ' LEU . 92.2 mt -99.46 -2.03 37.03 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.32 -0.862 . . . . 0.25 111.451 -178.656 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.492 HG12 ' O ' ' A' ' 102' ' ' ASN . 7.7 p . . . . . 0 N--CA 1.498 1.965 0 O-C-N 120.568 -1.333 . . . . 1.08 109.298 179.935 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_endo . . . . . 0 N--CA 1.498 1.786 0 CA-C-O 121.239 0.433 . . . . 1.46 111.694 . . . . . . . . . 0 0 . 1 . 024 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -95.46 120.29 35.44 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.199 -0.938 . . . . 0.88 109.537 -179.982 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.403 ' O ' ' O ' ' B' ' 64' ' ' ILE . 27.4 m -104.21 127.51 51.83 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 121.404 -0.81 . . . . 0.7 109.614 179.94 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 76.7 mt -68.31 -32.43 72.56 Favored 'General case' 0 N--CA 1.489 1.485 0 O-C-N 121.445 -0.785 . . . . 0.61 109.448 179.102 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 62.4 mmtt -61.58 -19.75 62.55 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.421 -0.8 . . . . 1.31 109.614 -178.869 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.493 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.2 mm -131.9 142.06 43.95 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.342 0 O-C-N 121.776 -0.577 . . . . 0.15 109.89 -179.101 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 17.9 m -99.7 125.26 45.54 Favored 'General case' 0 N--CA 1.499 2.0 0 N-CA-C 106.937 -1.505 . . . . 0.19 106.937 177.157 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 69.5 m -77.99 140.89 39.22 Favored 'General case' 0 N--CA 1.498 1.947 0 O-C-N 120.897 -1.127 . . . . 0.2 110.386 -178.415 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.447 ' C ' ' N ' ' B' ' 69' ' ' VAL . 22.1 m95 -75.06 -10.13 59.18 Favored 'General case' 0 N--CA 1.495 1.794 0 O-C-N 121.183 -0.948 . . . . 0.21 109.252 179.785 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.51 -12.37 0.17 Allowed 'General case' 0 N--CA 1.489 1.491 0 O-C-N 121.334 -0.854 . . . . 0.49 108.862 179.784 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.447 ' N ' ' C ' ' B' ' 67' ' ' TRP . 14.6 m -63.77 143.29 15.79 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.47 0 O-C-N 121.385 -0.822 . . . . 1.04 109.485 -179.892 . . . . . . . . 2 2 . 1 . 024 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 69.5 m-20 -59.98 -37.19 78.93 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 121.131 -0.981 . . . . 1.36 109.127 -179.494 . . . . . . . . 1 1 . 1 . 024 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.992 0 N-CA-C 109.251 -1.539 . . . . 2.32 109.251 -179.811 . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ptt? . . . . . 0 N--CA 1.493 1.68 0 N-CA-C 109.482 -0.562 . . . . 2.88 109.482 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.5 t -98.96 148.4 6.19 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.156 0 O-C-N 121.367 -0.833 . . . . 0.45 110.024 -179.639 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.0 tptm -130.05 129.41 43.6 Favored 'General case' 0 N--CA 1.497 1.891 0 N-CA-C 108.355 -0.98 . . . . 1.67 108.355 179.67 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 59.8 tt0 -98.66 124.97 43.79 Favored 'General case' 0 N--CA 1.497 1.913 0 O-C-N 121.246 -0.909 . . . . 0.31 108.727 178.667 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 29.1 mm -103.38 113.28 39.75 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.536 0 N-CA-C 108.551 -0.907 . . . . 0.19 108.551 179.659 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 73.2 mm-40 -98.26 0.0 44.84 Favored 'General case' 0 N--CA 1.493 1.688 0 O-C-N 121.316 -0.865 . . . . 2.25 110.04 -179.819 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.4 p -151.63 155.42 38.35 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 121.042 -1.036 . . . . 0.15 111.217 -179.934 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.426 ' HZ2' ' HB3' ' A' ' 8' ' ' LYS . 9.8 ttpp -64.82 -31.87 73.3 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.491 -0.929 . . . . 1.65 108.491 178.321 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.401 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 93.5 m -57.44 -49.82 75.01 Favored 'General case' 0 N--CA 1.493 1.685 0 O-C-N 121.107 -0.996 . . . . 0.23 109.465 -179.472 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.95 -29.58 67.84 Favored 'General case' 0 C--N 1.297 -1.678 0 C-N-CA 119.416 -0.914 . . . . 0.17 108.863 179.015 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.487 ' CE2' HD11 ' A' ' 15' ' ' LEU . 49.1 t80 -59.78 -44.04 94.09 Favored 'General case' 0 N--CA 1.496 1.836 0 O-C-N 121.177 -0.952 . . . . 0.14 109.518 179.988 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.4 mm100 -64.74 -43.08 94.5 Favored 'General case' 0 C--N 1.294 -1.838 0 N-CA-C 108.542 -0.91 . . . . 1.31 108.542 -179.788 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.531 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -65.04 -37.5 87.8 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.762 -0.586 . . . . 1.77 110.171 179.468 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.48 -41.26 84.87 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.089 -1.007 . . . . 0.15 108.949 -179.089 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.487 HD11 ' CE2' ' A' ' 11' ' ' PHE . 82.4 mt -60.24 -39.85 88.17 Favored 'General case' 0 C--N 1.305 -1.353 0 O-C-N 121.188 -0.945 . . . . 0.17 108.828 179.239 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 24.9 t0 -69.55 -36.3 76.23 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 121.53 -0.731 . . . . 1.07 110.335 -179.555 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.39 -35.93 76.26 Favored 'General case' 0 N--CA 1.495 1.812 0 O-C-N 121.316 -0.865 . . . . 0.18 110.512 -178.725 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.35 -30.95 71.54 Favored 'General case' 0 C--N 1.301 -1.542 0 O-C-N 121.106 -0.996 . . . . 0.17 109.301 -179.697 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.22 -125.85 24.88 Favored Glycine 0 N--CA 1.487 2.061 0 N-CA-C 109.465 -1.454 . . . . 0.2 109.465 -179.772 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 74.6 m-20 -92.17 5.16 51.42 Favored 'General case' 0 N--CA 1.495 1.795 0 O-C-N 121.294 -1.121 . . . . 1.07 110.729 -179.304 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 70.1 mttt -74.69 148.88 40.16 Favored 'General case' 0 N--CA 1.498 1.969 0 O-C-N 120.79 -1.194 . . . . 1.5 108.947 -179.841 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.69 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -59.82 159.82 8.42 Favored 'General case' 0 N--CA 1.486 1.344 0 N-CA-C 106.638 -1.616 . . . . 0.47 106.638 -179.973 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.69 ' H ' HD23 ' A' ' 22' ' ' LEU . 78.8 t -147.35 111.06 0.77 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.425 0 O-C-N 120.75 -1.219 . . . . 0.17 108.937 -179.66 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.7 t -101.34 144.16 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 N-CA-C 108.255 -1.017 . . . . 0.14 108.255 179.526 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 24.2 t -126.66 121.66 59.02 Favored 'Isoleucine or valine' 0 N--CA 1.503 2.208 0 O-C-N 121.333 -0.854 . . . . 0.13 109.52 -179.258 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.547 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 36.7 t70 -99.28 119.94 38.74 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 121.284 -0.885 . . . . 1.05 110.051 179.499 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.3 m-85 -95.52 21.96 7.62 Favored 'General case' 0 N--CA 1.5 2.067 0 O-C-N 121.145 -0.972 . . . . 0.73 109.645 178.92 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.9 m -55.81 147.86 18.05 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.818 -1.176 . . . . 0.3 110.305 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.501 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -86.56 126.59 34.58 Favored 'General case' 0 N--CA 1.486 1.345 0 N-CA-C 108.174 -1.047 . . . . 0.22 108.174 179.422 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.4 t -67.91 -30.21 69.48 Favored 'General case' 0 C--N 1.304 -1.407 0 C-N-CA 119.207 -0.997 . . . . 0.3 109.191 -179.462 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.527 ' NE1' ' OD1' ' A' ' 60' ' ' ASP . 59.2 p-90 -75.79 -18.06 59.64 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 119.076 -1.05 . . . . 0.26 110.15 179.925 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 35.0 t -83.8 121.64 27.59 Favored 'General case' 0 N--CA 1.492 1.655 0 O-C-N 120.979 -1.075 . . . . 0.26 108.402 179.843 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.458 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -63.39 -55.03 28.01 Favored Glycine 0 N--CA 1.495 2.576 0 O-C-N 121.518 -0.739 . . . . 0.23 112.534 -178.005 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.458 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.8 Cg_endo -60.7 -29.93 89.35 Favored 'Trans proline' 0 N--CA 1.49 1.299 0 CA-C-N 119.412 1.606 . . . . 0.31 112.09 -179.469 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -74.61 -49.76 20.41 Favored 'General case' 0 C--N 1.303 -1.432 0 N-CA-C 108.118 -1.067 . . . . 0.24 108.118 179.008 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 81.4 tttt -60.37 -32.35 71.21 Favored 'General case' 0 N--CA 1.491 1.621 0 N-CA-C 108.158 -1.053 . . . . 1.59 108.158 177.962 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.7 tpt -57.88 -28.04 63.82 Favored 'General case' 0 C--N 1.303 -1.424 0 CA-C-N 116.007 -0.542 . . . . 2.1 110.112 -179.334 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.84 HD11 ' HB1' ' A' ' 92' ' ' ALA . 81.9 mt -85.25 -0.92 6.48 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.87 0 O-C-N 121.458 -0.776 . . . . 0.49 111.573 -178.926 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.564 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.74 -30.75 6.84 Favored Pre-proline 0 C--N 1.302 -1.497 0 O-C-N 120.263 -1.523 . . . . 0.8 113.045 -178.768 . . . . . . . . 3 3 . 1 . 025 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.564 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.7 Cg_exo -59.7 -44.21 33.04 Favored 'Trans proline' 0 N--CA 1.489 1.263 0 CA-C-N 121.542 1.586 . . . . 0.28 112.91 -178.124 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.7 m-85 -69.54 -45.38 68.93 Favored 'General case' 0 N--CA 1.486 1.358 0 C-N-CA 118.36 -1.336 . . . . 0.37 108.948 179.938 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.6 t80 -61.31 -52.29 65.32 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 120.988 -1.07 . . . . 0.16 109.701 178.616 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -68.07 -42.49 80.35 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.536 -0.727 . . . . 0.32 111.548 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.433 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.1 m -62.74 -39.87 95.46 Favored 'General case' 0 N--CA 1.5 2.03 0 O-C-N 120.882 -1.136 . . . . 0.22 110.79 -179.202 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 38.5 mt -61.32 -23.78 65.97 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.331 -0.856 . . . . 0.22 110.755 -178.338 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 59.8 m -54.27 -35.32 62.41 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 121.094 -1.004 . . . . 0.16 109.009 -178.89 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 mp0 -88.3 -13.0 41.92 Favored 'General case' 0 C--N 1.303 -1.424 0 O-C-N 121.082 -1.011 . . . . 2.16 108.734 179.183 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 62.0 tttp -80.52 -37.51 31.44 Favored 'General case' 0 N--CA 1.493 1.699 0 N-CA-C 107.445 -1.317 . . . . 1.78 107.445 178.408 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 72.7 m-85 -121.9 68.2 0.92 Allowed 'General case' 0 N--CA 1.494 1.75 0 N-CA-C 106.986 -1.487 . . . . 0.25 106.986 178.138 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.1 p -64.01 -9.71 17.49 Favored 'General case' 0 C--N 1.306 -1.311 0 N-CA-C 108.492 -0.929 . . . . 0.22 108.492 -179.606 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 38.9 t30 -90.47 7.73 37.42 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 108.312 -0.996 . . . . 1.13 108.312 178.805 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.476 HG13 ' HB3' ' A' ' 22' ' ' LEU . 45.7 t -127.23 143.32 40.95 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 N-CA-C 107.415 -1.328 . . . . 0.24 107.415 178.819 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 23.1 mm -99.78 124.13 52.98 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.973 0 O-C-N 121.097 -1.002 . . . . 0.15 109.501 -178.516 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.565 ' C ' HD12 ' A' ' 55' ' ' LEU . 40.0 m-85 -104.15 127.31 51.74 Favored 'General case' 0 N--CA 1.505 2.278 0 O-C-N 121.333 -0.855 . . . . 0.12 109.503 179.188 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.565 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.6 mp -110.42 139.86 45.21 Favored 'General case' 0 N--CA 1.501 2.117 0 O-C-N 121.3 -0.875 . . . . 0.22 109.218 178.239 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -110.06 130.34 55.55 Favored 'General case' 0 N--CA 1.491 1.585 0 N-CA-C 106.982 -1.488 . . . . 1.13 106.982 178.164 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.4 t -128.28 134.04 65.69 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.009 0 O-C-N 121.354 -0.841 . . . . 0.15 110.74 -177.834 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.437 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 59.0 t0 -95.86 119.43 34.34 Favored 'General case' 0 N--CA 1.496 1.83 0 N-CA-C 109.011 -0.737 . . . . 1.05 109.011 179.45 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.8 m -68.23 -16.38 20.93 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.52 0 O-C-N 120.476 -1.39 . . . . 0.16 108.39 179.223 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.9 m-20 -93.85 -41.47 9.62 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.337 -0.852 . . . . 1.08 111.261 -178.836 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.403 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 25.6 m-20 -95.74 -22.2 17.68 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.844 -1.16 . . . . 1.07 108.747 179.81 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.437 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -118.46 39.92 3.34 Favored 'General case' 0 N--CA 1.494 1.765 0 N-CA-C 107.866 -1.161 . . . . 0.14 107.866 179.534 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.0 pt20 -60.08 -22.1 62.31 Favored 'General case' 0 C--N 1.303 -1.428 0 O-C-N 121.785 -0.572 . . . . 1.47 110.059 -178.469 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.587 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -65.37 -36.46 84.05 Favored 'General case' 0 C--N 1.303 -1.455 0 O-C-N 120.701 -1.249 . . . . 1.05 109.196 179.665 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.587 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.5 t -73.68 -43.99 53.42 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.05 -1.031 . . . . 0.35 109.395 179.997 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -69.95 -39.91 75.77 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.54 -0.725 . . . . 0.26 110.477 -178.743 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.8 p -60.77 -33.45 72.98 Favored 'General case' 0 N--CA 1.492 1.649 0 O-C-N 121.011 -1.056 . . . . 0.24 109.129 -179.739 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 74.8 tt0 -62.07 -39.87 93.87 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.406 -0.809 . . . . 2.06 109.438 179.543 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.414 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -88.76 1.34 55.36 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.313 -0.867 . . . . 0.23 111.162 -178.318 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 79.0 mm-40 55.07 49.64 17.08 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.253 -0.905 . . . . 2.02 109.034 -179.291 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.4 t -63.78 130.7 28.93 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.358 0 N-CA-C 107.41 -1.33 . . . . 0.16 107.41 -179.504 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.4 mmtt -102.88 -12.12 17.76 Favored 'General case' 0 N--CA 1.488 1.45 0 O-C-N 121.624 -0.673 . . . . 1.6 109.998 -178.779 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.46 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.45 156.3 20.97 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 120.845 -1.159 . . . . 0.14 111.26 -179.775 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.489 HG23 ' NE1' ' B' ' 67' ' ' TRP . 30.4 p -124.6 154.62 69.97 Favored Pre-proline 0 N--CA 1.499 2.01 0 N-CA-C 108.133 -1.062 . . . . 0.15 108.133 178.933 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.1 Cg_endo -77.32 145.52 80.59 Favored 'Cis proline' 0 N--CA 1.492 1.406 0 C-N-CA 123.542 -1.441 . . . . 0.16 112.359 -3.115 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.46 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.6 m -128.41 131.1 48.47 Favored 'General case' 0 N--CA 1.5 2.032 0 N-CA-C 108.564 -0.902 . . . . 0.13 108.564 178.125 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.799 ' CD1' HD21 ' A' ' 97' ' ' LEU . 89.8 m-85 -109.84 130.16 55.56 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.631 -0.668 . . . . 0.2 109.455 -179.207 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.414 HE22 ' CB ' ' A' ' 69' ' ' ALA . 72.2 mt-30 -120.63 140.45 51.54 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.41 -0.807 . . . . 0.29 109.04 179.104 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 77.8 m-85 -107.9 131.97 53.95 Favored 'General case' 0 C--N 1.298 -1.644 0 CA-C-O 121.117 0.484 . . . . 0.14 110.077 -179.341 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 83.8 m-85 -124.84 145.83 49.58 Favored 'General case' 0 N--CA 1.491 1.612 0 CA-C-O 121.492 0.663 . . . . 0.15 109.432 179.439 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 43.8 tptt -146.27 127.35 14.65 Favored 'General case' 0 C--N 1.304 -1.375 0 N-CA-C 107.325 -1.361 . . . . 1.68 107.325 179.954 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 76.1 mttt 54.95 33.25 19.69 Favored 'General case' 0 N--CA 1.498 1.934 0 O-C-N 121.319 -0.863 . . . . 1.22 110.072 -178.587 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.9 21.5 76.29 Favored Glycine 0 N--CA 1.491 2.312 0 O-C-N 120.913 -1.117 . . . . 0.23 110.921 178.899 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.2 mt-30 -131.02 141.51 50.23 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 121.209 -1.171 . . . . 2.07 109.786 179.802 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 34.0 ttmt -77.67 126.84 31.49 Favored 'General case' 0 N--CA 1.5 2.043 0 O-C-N 120.98 -1.075 . . . . 1.82 109.51 179.81 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 13.0 m -122.25 12.1 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.953 0 O-C-N 121.766 -0.584 . . . . 0.3 110.187 -179.472 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.33 152.04 10.72 Favored Glycine 0 N--CA 1.493 2.447 0 C-N-CA 118.681 -1.723 . . . . 0.17 111.268 179.645 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.483 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.5 tp10 -163.04 137.49 6.29 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.819 -0.812 . . . . 1.93 109.451 179.942 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.483 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.2 p90 -163.37 158.82 21.68 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 119.591 -0.844 . . . . 0.14 109.976 178.211 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.5 p -125.97 161.66 27.0 Favored 'General case' 0 N--CA 1.5 2.045 0 CA-C-O 121.326 0.584 . . . . 0.12 109.792 -178.783 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.455 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.6 141.71 5.89 Favored Glycine 0 N--CA 1.496 2.645 0 N-CA-C 109.639 -1.384 . . . . 0.12 109.639 179.36 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.84 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -79.59 67.28 5.3 Favored 'General case' 0 C--N 1.304 -1.401 0 O-C-N 121.134 -1.216 . . . . 0.18 109.669 -179.932 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 99.01 6.36 Favored 'General case' 0 N--CA 1.5 2.075 0 N-CA-C 108.684 -0.858 . . . . 0.88 108.684 179.112 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.45 -35.03 75.26 Favored 'General case' 0 N--CA 1.499 1.985 0 O-C-N 121.157 -0.964 . . . . 1.06 111.479 -179.013 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.2 mm-40 -64.13 -30.04 71.12 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.992 -1.067 . . . . 1.61 109.657 179.564 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 22.8 ttmt -60.96 -37.4 82.29 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.693 -0.63 . . . . 1.45 109.612 -179.643 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.799 HD21 ' CD1' ' A' ' 77' ' ' PHE . 47.3 mt -58.77 -38.49 78.6 Favored 'General case' 0 N--CA 1.486 1.349 0 N-CA-C 108.438 -0.949 . . . . 0.19 108.438 179.672 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 45.1 tp10 -63.99 -40.68 96.91 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 120.252 -0.579 . . . . 2.1 110.748 -178.444 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.09 -43.92 73.56 Favored 'General case' 0 N--CA 1.491 1.595 0 O-C-N 121.082 -1.011 . . . . 0.19 111.651 -178.567 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 21.7 m -65.29 -40.01 93.29 Favored 'General case' 0 N--CA 1.49 1.539 0 O-C-N 120.759 -1.213 . . . . 0.2 109.923 -178.777 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 48.7 mt -61.36 -51.63 70.77 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.855 0 O-C-N 121.255 -0.903 . . . . 0.16 108.982 -179.733 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.486 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.3 t30 -60.33 -34.24 73.54 Favored 'General case' 0 N--CA 1.489 1.523 0 N-CA-C 108.334 -0.988 . . . . 0.95 108.334 179.29 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 35.3 tp10 -68.05 -39.91 82.91 Favored 'General case' 0 C--N 1.298 -1.631 0 O-C-N 121.611 -0.681 . . . . 2.21 110.426 -178.823 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.561 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.8 mt -99.58 -1.98 36.82 Favored 'General case' 0 N--CA 1.497 1.896 0 O-C-N 121.284 -0.885 . . . . 0.25 110.971 -178.666 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.486 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.667 -1.271 . . . . 1.08 109.3 -179.776 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 89.0 Cg_exo . . . . . 0 N--CA 1.494 1.547 0 CA-C-O 121.247 0.436 . . . . 1.46 112.114 . . . . . . . . . 0 0 . 1 . 025 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.3 124.2 33.09 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.228 -0.92 . . . . 0.88 108.924 179.229 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 24.3 m -108.39 130.2 55.23 Favored 'General case' 0 N--CA 1.5 2.066 0 O-C-N 121.462 -0.774 . . . . 0.7 109.124 -179.836 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 75.7 mt -67.42 -30.02 69.66 Favored 'General case' 0 N--CA 1.492 1.647 0 O-C-N 121.277 -0.889 . . . . 0.61 109.892 -179.742 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 70.1 mmtt -59.32 -22.02 60.62 Favored 'General case' 0 N--CA 1.489 1.503 0 N-CA-C 108.963 -0.754 . . . . 1.31 108.963 -179.802 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.455 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.6 mm -128.41 140.34 49.48 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.423 0 N-CA-C 109.558 -0.534 . . . . 0.15 109.558 -179.68 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.5 m -100.58 124.63 46.42 Favored 'General case' 0 N--CA 1.504 2.243 0 N-CA-C 107.102 -1.444 . . . . 0.19 107.102 178.002 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.5 m -75.51 140.04 42.55 Favored 'General case' 0 N--CA 1.501 2.075 0 O-C-N 120.94 -1.1 . . . . 0.2 111.468 -177.873 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.489 ' NE1' HG23 ' A' ' 74' ' ' THR . 19.8 m95 -75.42 -10.23 59.27 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 121.352 -0.843 . . . . 0.21 108.807 178.779 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.6 m120 -51.28 -12.57 0.15 Allowed 'General case' 0 N--CA 1.492 1.661 0 N-CA-C 108.582 -0.895 . . . . 0.49 108.582 179.319 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.461 ' N ' ' C ' ' B' ' 67' ' ' TRP . 18.3 m -63.27 146.05 13.18 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.575 0 O-C-N 121.464 -0.773 . . . . 1.04 109.659 179.822 . . . . . . . . 2 2 . 1 . 025 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 63.7 m-20 -60.28 -39.88 88.41 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.188 -0.945 . . . . 1.36 109.887 179.855 . . . . . . . . 1 1 . 1 . 025 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.491 2.353 0 CA-C-O 118.101 -1.388 . . . . 2.32 109.724 -179.371 . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.6 mmt . . . . . 0 N--CA 1.491 1.575 0 N-CA-C 109.475 -0.565 . . . . 2.88 109.475 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . 0.544 HG12 ' N ' ' A' ' 3' ' ' LYS . 92.7 t -99.42 161.98 3.07 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.092 0 O-C-N 121.56 -0.712 . . . . 0.45 109.838 -179.779 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . 0.544 ' N ' HG12 ' A' ' 2' ' ' VAL . 28.0 tptp -130.09 129.83 44.08 Favored 'General case' 0 N--CA 1.497 1.919 0 N-CA-C 108.521 -0.918 . . . . 1.67 108.521 179.655 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.9 tt0 -98.6 124.14 43.21 Favored 'General case' 0 N--CA 1.493 1.683 0 O-C-N 121.493 -0.755 . . . . 0.31 109.429 179.784 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.26 113.98 37.51 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.646 0 N-CA-C 108.329 -0.989 . . . . 0.19 108.329 178.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 39.2 mm-40 -98.65 -0.52 42.81 Favored 'General case' 0 N--CA 1.494 1.733 0 O-C-N 121.239 -0.913 . . . . 2.25 109.689 -179.757 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -155.25 157.89 37.97 Favored 'General case' 0 N--CA 1.497 1.89 0 O-C-N 121.057 -1.027 . . . . 0.15 110.948 179.782 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -65.16 -30.96 71.92 Favored 'General case' 0 N--CA 1.486 1.353 0 N-CA-C 107.777 -1.194 . . . . 1.65 107.777 178.43 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 24.8 m -58.98 -47.36 85.44 Favored 'General case' 0 N--CA 1.486 1.367 0 O-C-N 121.327 -0.858 . . . . 0.23 108.941 -179.565 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.1 -29.76 68.77 Favored 'General case' 0 C--N 1.299 -1.598 0 N-CA-C 108.697 -0.853 . . . . 0.17 108.697 178.702 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.527 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.0 t80 -59.72 -44.78 93.59 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.227 -0.92 . . . . 0.14 109.259 -179.683 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.9 mm100 -64.27 -43.65 94.19 Favored 'General case' 0 C--N 1.298 -1.64 0 CA-C-O 121.809 0.814 . . . . 1.31 108.992 179.851 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 -65.17 -37.36 87.12 Favored 'General case' 0 N--CA 1.491 1.623 0 CA-C-O 121.341 0.591 . . . . 1.77 110.804 -179.867 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.75 -41.74 82.88 Favored 'General case' 0 C--N 1.298 -1.637 0 O-C-N 121.34 -0.85 . . . . 0.15 108.891 -179.373 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.527 HD11 ' CE2' ' A' ' 11' ' ' PHE . 63.3 mt -60.55 -40.2 90.71 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.352 -0.843 . . . . 0.17 108.791 179.638 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 45.8 t0 -70.26 -32.53 70.39 Favored 'General case' 0 C--N 1.306 -1.303 0 O-C-N 121.379 -0.825 . . . . 1.07 109.829 179.932 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.51 -41.44 79.97 Favored 'General case' 0 N--CA 1.494 1.736 0 O-C-N 121.298 -0.876 . . . . 0.18 109.768 -179.078 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.24 -35.83 76.36 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.278 -0.889 . . . . 0.17 109.317 -179.976 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.89 -123.92 16.3 Favored Glycine 0 N--CA 1.49 2.244 0 N-CA-C 109.963 -1.255 . . . . 0.2 109.963 -179.734 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -89.42 2.3 54.66 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.971 -1.311 . . . . 1.07 110.589 -178.876 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 68.7 mttt -74.45 148.45 41.07 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 120.84 -1.162 . . . . 1.5 109.169 179.93 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.693 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.6 OUTLIER -60.37 159.4 10.22 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 106.773 -1.566 . . . . 0.47 106.773 179.708 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.693 ' H ' HD23 ' A' ' 22' ' ' LEU . 88.7 t -146.93 113.49 1.0 Allowed 'Isoleucine or valine' 0 C--N 1.301 -1.521 0 O-C-N 120.78 -1.2 . . . . 0.17 108.983 -179.567 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.0 t -101.35 141.75 17.31 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 N-CA-C 107.964 -1.125 . . . . 0.14 107.964 179.322 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 39.0 t -124.58 120.62 59.42 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.139 0 O-C-N 121.397 -0.814 . . . . 0.13 109.377 -179.226 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 33.7 t70 -99.47 118.66 36.56 Favored 'General case' 0 N--CA 1.5 2.059 0 O-C-N 121.418 -0.801 . . . . 1.05 110.447 179.595 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 76.4 m-85 -95.06 24.15 5.1 Favored 'General case' 0 N--CA 1.498 1.943 0 O-C-N 121.513 -0.742 . . . . 0.73 109.735 179.397 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.405 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.4 m -59.0 145.12 43.01 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.993 -1.067 . . . . 0.3 109.671 -178.835 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.734 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.33 124.04 31.5 Favored 'General case' 0 C--N 1.302 -1.495 0 N-CA-C 107.462 -1.31 . . . . 0.22 107.462 178.883 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -67.84 -31.79 71.87 Favored 'General case' 0 C--N 1.296 -1.746 0 N-CA-C 108.102 -1.073 . . . . 0.3 108.102 179.838 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.734 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.0 p-90 -70.54 -23.04 62.55 Favored 'General case' 0 N--CA 1.489 1.518 0 O-C-N 121.745 -0.597 . . . . 0.26 110.584 179.629 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.8 t -83.95 116.46 22.81 Favored 'General case' 0 N--CA 1.491 1.609 0 N-CA-C 107.333 -1.358 . . . . 0.26 107.333 179.54 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.478 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.54 -50.83 63.55 Favored Glycine 0 N--CA 1.49 2.294 0 C-N-CA 120.514 -0.851 . . . . 0.23 111.503 -177.692 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.478 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.8 Cg_exo -54.56 -35.02 84.9 Favored 'Trans proline' 0 C--N 1.306 -1.695 0 CA-C-N 118.518 1.159 . . . . 0.31 112.052 -179.803 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.405 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.69 -47.85 16.14 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.363 -0.835 . . . . 0.24 109.642 -179.83 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -60.12 -33.13 71.71 Favored 'General case' 0 N--CA 1.491 1.58 0 N-CA-C 108.193 -1.04 . . . . 1.59 108.193 178.901 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 10.9 tpt -59.78 -30.17 68.71 Favored 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.837 -0.539 . . . . 2.1 109.725 179.903 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.557 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.5 mt -83.87 -2.04 6.63 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.775 0 O-C-N 121.705 -0.622 . . . . 0.49 110.88 -178.603 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.549 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.72 -30.81 7.56 Favored Pre-proline 0 N--CA 1.493 1.718 0 O-C-N 120.423 -1.423 . . . . 0.8 113.028 -178.561 . . . . . . . . 3 3 . 1 . 026 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.549 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 24.4 Cg_exo -59.93 -42.17 47.2 Favored 'Trans proline' 0 N--CA 1.494 1.536 0 CA-C-N 121.641 1.622 . . . . 0.28 112.826 -177.549 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -68.52 -45.98 70.79 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 118.628 -1.229 . . . . 0.37 108.767 -179.78 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.4 t80 -63.12 -51.97 64.4 Favored 'General case' 0 C--N 1.299 -1.62 0 O-C-N 120.977 -1.077 . . . . 0.16 109.572 179.002 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 43.3 t60 -67.46 -40.1 85.35 Favored 'General case' 0 C--N 1.298 -1.655 0 O-C-N 121.707 -0.62 . . . . 0.32 111.106 -179.444 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.425 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.8 m -63.88 -36.29 83.45 Favored 'General case' 0 N--CA 1.5 2.048 0 O-C-N 120.878 -1.139 . . . . 0.22 110.752 -179.93 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 34.8 mt -63.56 -20.82 65.95 Favored 'General case' 0 N--CA 1.49 1.547 0 O-C-N 121.212 -0.93 . . . . 0.22 110.656 -177.887 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.1 m -54.93 -36.46 65.29 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 120.917 -1.114 . . . . 0.16 108.632 -179.648 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 36.7 mp0 -88.18 -15.95 34.65 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.131 -0.98 . . . . 2.16 109.9 179.659 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.0 tttt -79.3 -37.42 37.76 Favored 'General case' 0 N--CA 1.495 1.775 0 N-CA-C 107.169 -1.419 . . . . 1.78 107.169 179.147 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . 0.405 ' C ' ' H ' ' A' ' 51' ' ' ASN . 77.6 m-85 -123.77 67.01 1.03 Allowed 'General case' 0 N--CA 1.495 1.804 0 N-CA-C 107.374 -1.343 . . . . 0.25 107.374 178.169 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 72.6 p -63.35 -5.72 3.86 Favored 'General case' 0 C--N 1.307 -1.272 0 N-CA-C 108.14 -1.059 . . . . 0.22 108.14 -179.85 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.405 ' H ' ' C ' ' A' ' 49' ' ' TYR . 1.7 t-20 -79.99 -20.41 45.54 Favored 'General case' 0 C--N 1.305 -1.343 0 N-CA-C 109.223 -0.658 . . . . 1.13 109.223 178.647 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.552 HG13 ' HB3' ' A' ' 22' ' ' LEU . 60.8 t -107.01 149.46 10.42 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.403 0 N-CA-C 108.774 -0.824 . . . . 0.24 108.774 -179.577 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.8 mm -99.79 120.0 48.61 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.869 0 O-C-N 121.258 -0.901 . . . . 0.15 108.678 -179.27 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.604 ' C ' HD12 ' A' ' 55' ' ' LEU . 44.2 m-85 -99.63 126.15 45.58 Favored 'General case' 0 N--CA 1.506 2.342 0 O-C-N 121.238 -0.914 . . . . 0.12 110.221 179.965 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.604 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.3 mp -111.49 141.59 44.86 Favored 'General case' 0 N--CA 1.503 2.183 0 O-C-N 121.225 -0.922 . . . . 0.22 109.35 178.78 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -109.23 132.1 54.44 Favored 'General case' 0 N--CA 1.493 1.689 0 N-CA-C 106.853 -1.536 . . . . 1.13 106.853 178.338 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 40.0 t -127.89 131.09 70.0 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.871 0 O-C-N 121.448 -0.782 . . . . 0.15 109.858 -178.052 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.685 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.5 t0 -94.27 120.31 34.32 Favored 'General case' 0 N--CA 1.492 1.654 0 O-C-N 121.436 -0.79 . . . . 1.05 108.898 179.758 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.0 m -67.46 -19.52 25.35 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.517 0 O-C-N 120.627 -1.296 . . . . 0.16 108.329 179.203 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.53 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 17.6 m-20 -92.03 -45.04 8.52 Favored 'General case' 0 N--CA 1.493 1.702 0 O-C-N 121.509 -0.744 . . . . 1.08 111.726 -179.271 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.448 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 18.1 m-20 -93.97 -13.59 26.87 Favored 'General case' 0 N--CA 1.502 2.169 0 O-C-N 120.566 -1.334 . . . . 1.07 108.195 179.553 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.685 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.99 36.98 4.51 Favored 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 107.734 -1.21 . . . . 0.14 107.734 179.877 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.6 pt20 -60.03 -24.43 64.51 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.687 -0.633 . . . . 1.47 109.645 -178.803 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.538 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -66.67 -38.61 87.17 Favored 'General case' 0 C--N 1.3 -1.553 0 O-C-N 120.875 -1.141 . . . . 1.05 108.33 178.793 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.538 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 3.8 t -69.23 -44.54 80.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.483 0 O-C-N 121.395 -0.816 . . . . 0.35 109.626 179.911 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.56 -37.22 68.29 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.371 -0.831 . . . . 0.26 110.726 -178.664 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -60.24 -37.41 80.27 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.165 -0.959 . . . . 0.24 109.753 -178.785 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 15.4 tm-20 -63.07 -38.68 92.16 Favored 'General case' 0 C--N 1.3 -1.58 0 O-C-N 121.342 -0.849 . . . . 2.06 109.26 179.357 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.408 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -84.74 -1.46 56.28 Favored 'General case' 0 N--CA 1.489 1.508 0 O-C-N 121.47 -0.769 . . . . 0.23 111.014 -178.816 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 35.7 mp0 53.84 48.29 21.66 Favored 'General case' 0 N--CA 1.495 1.79 0 O-C-N 121.027 -1.046 . . . . 2.02 109.596 -179.864 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.8 t -63.22 134.37 28.42 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.603 0 C-N-CA 118.787 -1.165 . . . . 0.16 108.142 -179.619 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 29.6 mmtp -106.92 -12.3 15.5 Favored 'General case' 0 N--CA 1.489 1.482 0 O-C-N 121.563 -0.71 . . . . 1.6 109.797 -179.043 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.471 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 154.53 19.11 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.002 -1.061 . . . . 0.14 110.911 -179.98 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -127.62 154.5 77.69 Favored Pre-proline 0 N--CA 1.496 1.864 0 N-CA-C 107.726 -1.212 . . . . 0.15 107.726 178.611 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.0 Cg_endo -77.6 143.25 73.75 Favored 'Cis proline' 0 N--CA 1.489 1.248 0 C-N-CA 123.57 -1.429 . . . . 0.16 112.569 -2.183 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.427 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.5 m -128.37 133.84 48.72 Favored 'General case' 0 N--CA 1.497 1.879 0 N-CA-C 108.869 -0.789 . . . . 0.13 108.869 178.431 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.519 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 92.1 m-85 -110.71 131.02 55.41 Favored 'General case' 0 N--CA 1.492 1.649 0 N-CA-C 108.632 -0.877 . . . . 0.2 108.632 -179.413 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.408 HE22 ' HB1' ' A' ' 69' ' ' ALA . 72.3 mt-30 -122.47 140.19 53.02 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 108.533 -0.914 . . . . 0.29 108.533 179.429 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 73.8 m-85 -106.63 132.94 52.05 Favored 'General case' 0 N--CA 1.491 1.604 0 CA-C-O 121.377 0.608 . . . . 0.14 109.931 -179.411 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 79.6 m-85 -126.87 145.68 50.57 Favored 'General case' 0 N--CA 1.491 1.579 0 N-CA-C 109.013 -0.736 . . . . 0.15 109.013 179.248 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.8 ttmt -145.86 129.41 16.99 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 106.938 -1.505 . . . . 1.68 106.938 179.26 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 79.4 mttt 56.55 27.96 13.15 Favored 'General case' 0 N--CA 1.495 1.797 0 O-C-N 121.241 -0.912 . . . . 1.22 108.594 -178.025 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.94 25.02 67.83 Favored Glycine 0 N--CA 1.486 2.008 0 N-CA-C 109.689 -1.364 . . . . 0.23 109.689 -179.75 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.411 ' HA ' ' NE2' ' A' ' 84' ' ' GLN . 2.4 mm100 -128.69 136.18 50.26 Favored 'General case' 0 N--CA 1.5 2.031 0 O-C-N 121.394 -1.062 . . . . 2.07 110.362 -179.82 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 6.6 ttpm? -79.38 128.15 32.97 Favored 'General case' 0 N--CA 1.494 1.771 0 O-C-N 121.236 -0.915 . . . . 1.82 109.654 179.461 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 26.4 m -123.93 3.98 5.16 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.79 0 O-C-N 121.76 -0.587 . . . . 0.3 110.377 -179.775 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.22 155.89 17.1 Favored Glycine 0 N--CA 1.496 2.639 0 C-N-CA 118.648 -1.739 . . . . 0.17 111.506 -179.969 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.3 tm-20 -164.04 148.7 10.21 Favored 'General case' 0 N--CA 1.491 1.602 0 O-C-N 121.865 -0.785 . . . . 1.93 109.482 179.476 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.436 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 6.3 p90 -164.37 157.33 17.41 Favored 'General case' 0 N--CA 1.489 1.489 0 C-N-CA 119.613 -0.835 . . . . 0.14 109.913 178.218 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.2 p -125.8 160.41 29.89 Favored 'General case' 0 N--CA 1.496 1.828 0 CA-C-O 121.391 0.615 . . . . 0.12 109.673 -179.192 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.481 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.01 141.7 5.84 Favored Glycine 0 N--CA 1.487 2.052 0 N-CA-C 109.125 -1.59 . . . . 0.12 109.125 -179.91 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.457 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.01 65.76 2.1 Favored 'General case' 0 C--N 1.299 -1.613 0 O-C-N 121.378 -1.072 . . . . 0.18 109.57 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.99 96.98 5.39 Favored 'General case' 0 N--CA 1.501 2.102 0 O-C-N 121.217 -0.927 . . . . 0.88 108.567 179.062 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.71 -31.95 70.25 Favored 'General case' 0 C--N 1.299 -1.596 0 O-C-N 121.12 -0.988 . . . . 1.06 111.722 -179.279 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.28 -29.85 70.93 Favored 'General case' 0 N--CA 1.487 1.417 0 O-C-N 120.793 -1.192 . . . . 1.61 108.914 -179.492 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 74.6 tttt -61.04 -35.73 77.68 Favored 'General case' 0 C--N 1.3 -1.586 0 O-C-N 121.705 -0.622 . . . . 1.45 109.403 -179.434 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 56.3 mt -59.88 -39.86 86.76 Favored 'General case' 0 C--N 1.3 -1.566 0 CA-C-O 122.136 0.97 . . . . 0.19 108.508 179.252 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 14.0 tm-20 -61.99 -43.76 98.16 Favored 'General case' 0 C--N 1.292 -1.931 0 CA-C-N 115.755 -0.657 . . . . 2.1 111.087 -177.677 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.93 -44.1 73.74 Favored 'General case' 0 C--N 1.297 -1.711 0 O-C-N 121.035 -1.041 . . . . 0.19 111.659 -178.323 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -66.13 -40.2 90.46 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 120.87 -1.144 . . . . 0.2 110.165 -178.444 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 60.3 mt -60.36 -50.11 81.61 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.709 0 O-C-N 121.036 -1.04 . . . . 0.16 108.548 179.351 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.461 ' O ' HG12 ' A' ' 105' ' ' VAL . 24.9 t-20 -59.94 -36.39 76.95 Favored 'General case' 0 C--N 1.3 -1.548 0 CA-C-O 121.905 0.86 . . . . 0.95 108.846 179.209 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.2 tm-20 -67.72 -39.9 84.28 Favored 'General case' 0 C--N 1.297 -1.676 0 O-C-N 121.812 -0.555 . . . . 2.21 109.846 -178.644 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.687 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.8 mt -97.56 -4.53 37.58 Favored 'General case' 0 N--CA 1.498 1.948 0 O-C-N 121.152 -0.968 . . . . 0.25 111.267 -179.201 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.461 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.0 p . . . . . 0 N--CA 1.495 1.815 0 O-C-N 120.411 -1.431 . . . . 1.08 109.285 -179.48 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 52.5 Cg_exo . . . . . 0 N--CA 1.492 1.423 0 CA-C-O 121.081 0.367 . . . . 1.46 112.534 . . . . . . . . . 0 0 . 1 . 026 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -75.95 130.25 38.18 Favored 'General case' 0 N--CA 1.492 1.672 0 O-C-N 120.901 -1.124 . . . . 0.88 109.744 -179.806 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.476 HG22 ' H ' ' B' ' 63' ' ' LYS . 22.7 m -105.75 131.81 52.64 Favored 'General case' 0 N--CA 1.499 2.017 0 O-C-N 121.541 -0.725 . . . . 0.7 109.71 -179.972 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 40.0 mt -67.65 -30.12 69.6 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.238 -0.914 . . . . 0.61 109.302 179.508 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.476 ' H ' HG22 ' B' ' 61' ' ' THR . 41.2 mmtm -61.22 -11.42 9.3 Favored 'General case' 0 C--N 1.299 -1.6 0 N-CA-C 109.129 -0.693 . . . . 1.31 109.129 -179.486 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.481 HD11 ' HA2' ' A' ' 91' ' ' GLY . 32.1 mm -130.04 140.27 49.35 Favored 'Isoleucine or valine' 0 N--CA 1.511 2.586 0 O-C-N 122.045 -0.409 . . . . 0.15 110.232 -179.339 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 27.8 m -98.9 130.54 45.3 Favored 'General case' 0 N--CA 1.503 2.181 0 N-CA-C 107.348 -1.353 . . . . 0.19 107.348 177.497 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . 0.442 ' O ' HG12 ' B' ' 69' ' ' VAL . 54.1 m -81.25 144.79 31.31 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 120.721 -1.237 . . . . 0.2 110.875 -178.189 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.471 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 25.0 m95 -79.72 -15.49 57.42 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.236 -0.915 . . . . 0.21 109.53 178.727 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -59.08 -10.98 3.03 Favored 'General case' 0 C--N 1.303 -1.442 0 N-CA-C 107.465 -1.309 . . . . 0.49 107.465 179.126 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.536 HG22 ' H ' ' B' ' 71' ' ' GLY . 7.6 p -64.79 141.44 18.22 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.442 0 N-CA-C 109.093 -0.706 . . . . 1.04 109.093 179.922 . . . . . . . . 2 2 . 1 . 026 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.8 m-20 -60.0 -37.33 79.38 Favored 'General case' 0 C--N 1.303 -1.456 0 O-C-N 121.282 -0.886 . . . . 1.36 109.205 -179.232 . . . . . . . . 1 1 . 1 . 026 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . 0.536 ' H ' HG22 ' B' ' 69' ' ' VAL . . . . . . . . 0 N--CA 1.491 2.331 0 N-CA-C 109.222 -1.551 . . . . 2.32 109.222 -179.891 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.8 mmt . . . . . 0 N--CA 1.492 1.635 0 CA-C-O 121.26 0.553 . . . . 2.88 109.528 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 95.0 t -99.34 145.42 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.974 0 O-C-N 121.489 -0.757 . . . . 0.45 109.386 179.761 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.1 tttp -130.0 128.28 41.71 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.272 -0.893 . . . . 1.67 109.037 -179.824 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -96.56 125.45 41.04 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.403 -0.811 . . . . 0.31 109.075 179.726 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 45.3 mm -100.32 111.26 29.46 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.742 0 N-CA-C 108.517 -0.92 . . . . 0.19 108.517 179.348 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.493 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 54.1 mp0 -98.88 -1.16 40.8 Favored 'General case' 0 N--CA 1.488 1.456 0 O-C-N 121.176 -0.952 . . . . 2.25 108.613 179.602 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -155.17 156.91 36.55 Favored 'General case' 0 N--CA 1.496 1.828 0 O-C-N 121.366 -0.834 . . . . 0.15 110.378 179.815 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.467 ' HZ1' ' HB2' ' A' ' 68' ' ' GLU . 15.4 ttmm -62.92 -33.37 75.2 Favored 'General case' 0 C--N 1.302 -1.469 0 N-CA-C 108.195 -1.039 . . . . 1.65 108.195 178.509 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.0 m -53.59 -49.51 67.63 Favored 'General case' 0 C--N 1.301 -1.534 0 C-N-CA 119.524 -0.87 . . . . 0.23 109.213 -178.55 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.43 -30.48 69.37 Favored 'General case' 0 C--N 1.297 -1.697 0 O-C-N 121.334 -0.854 . . . . 0.17 109.165 178.841 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.526 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.0 t80 -58.49 -45.28 89.03 Favored 'General case' 0 N--CA 1.495 1.796 0 O-C-N 120.897 -1.127 . . . . 0.14 108.927 -179.478 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 20.6 mm100 -64.88 -41.78 95.36 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.484 -0.76 . . . . 1.31 109.134 179.691 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.5 mm-40 -64.73 -39.72 94.12 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.703 -0.623 . . . . 1.77 110.819 -179.763 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.99 -41.59 82.08 Favored 'General case' 0 N--CA 1.491 1.607 0 O-C-N 121.044 -1.035 . . . . 0.15 109.016 -179.31 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.526 HD11 ' CE2' ' A' ' 11' ' ' PHE . 72.6 mt -60.22 -41.71 93.65 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 107.938 -1.134 . . . . 0.17 107.938 179.165 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -69.49 -37.02 77.06 Favored 'General case' 0 N--CA 1.488 1.459 0 O-C-N 121.572 -0.705 . . . . 1.07 110.273 179.813 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.24 -39.64 82.23 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.239 -0.913 . . . . 0.18 110.429 -179.203 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.23 -27.91 69.33 Favored 'General case' 0 N--CA 1.491 1.61 0 O-C-N 121.243 -0.91 . . . . 0.17 108.952 -179.748 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.04 -126.36 28.78 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.625 -1.39 . . . . 0.2 109.625 -179.915 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 69.0 m-20 -90.69 4.52 51.25 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.118 -1.225 . . . . 1.07 110.059 -179.192 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . 0.413 ' HZ2' ' HG2' ' A' ' 21' ' ' LYS . 26.7 mtpp -74.75 150.52 39.37 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 120.873 -1.142 . . . . 1.5 109.079 -179.846 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.653 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.4 OUTLIER -59.62 159.5 8.41 Favored 'General case' 0 N--CA 1.488 1.452 0 N-CA-C 107.511 -1.292 . . . . 0.47 107.511 -179.253 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.653 ' H ' HD23 ' A' ' 22' ' ' LEU . 61.8 t -147.25 116.89 1.31 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.452 0 O-C-N 120.993 -1.067 . . . . 0.17 108.3 179.516 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.8 t -104.31 144.01 15.09 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.606 0 N-CA-C 108.211 -1.033 . . . . 0.14 108.211 179.765 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 44.4 t -125.24 123.78 65.89 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.165 0 O-C-N 121.38 -0.825 . . . . 0.13 109.938 -179.322 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 60.0 t0 -100.98 120.16 39.77 Favored 'General case' 0 N--CA 1.502 2.172 0 O-C-N 121.28 -0.888 . . . . 1.05 110.075 179.725 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 58.7 m-85 -95.87 22.41 7.41 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 120.925 -1.109 . . . . 0.73 110.107 179.443 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -58.12 149.0 24.81 Favored 'General case' 0 C--N 1.296 -1.745 0 O-C-N 120.969 -1.082 . . . . 0.3 110.494 -178.057 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.596 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.59 124.18 31.85 Favored 'General case' 0 N--CA 1.487 1.413 0 N-CA-C 107.963 -1.125 . . . . 0.22 107.963 179.389 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.5 t -65.18 -32.07 73.57 Favored 'General case' 0 C--N 1.299 -1.615 0 C-N-CA 118.78 -1.168 . . . . 0.3 108.21 -179.795 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.596 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 51.9 p-90 -72.38 -24.37 61.25 Favored 'General case' 0 N--CA 1.496 1.869 0 O-C-N 121.326 -0.859 . . . . 0.26 111.495 179.672 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -82.8 116.65 22.23 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 120.584 -1.322 . . . . 0.26 109.304 -178.741 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.442 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.12 -51.98 54.92 Favored Glycine 0 N--CA 1.491 2.339 0 N-CA-C 111.267 -0.733 . . . . 0.23 111.267 -178.753 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.442 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 31.6 Cg_exo -50.98 -34.97 48.5 Favored 'Trans proline' 0 C--N 1.31 -1.497 0 CA-C-N 118.776 1.288 . . . . 0.31 111.673 179.518 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -79.8 -47.45 15.17 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.39 -0.818 . . . . 0.24 109.637 179.79 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 36.4 ttpt -59.74 -33.14 71.27 Favored 'General case' 0 N--CA 1.49 1.528 0 O-C-N 121.06 -1.025 . . . . 1.59 108.863 179.141 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 23.5 ttt -58.34 -26.21 62.84 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 121.516 -0.74 . . . . 2.1 109.969 179.366 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.489 HG22 ' O ' ' A' ' 38' ' ' ILE . 43.7 mt -86.27 -2.36 7.99 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.788 0 O-C-N 121.406 -0.809 . . . . 0.49 111.14 -178.705 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.553 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -63.38 -30.56 5.51 Favored Pre-proline 0 N--CA 1.492 1.63 0 O-C-N 120.187 -1.571 . . . . 0.8 113.298 -177.533 . . . . . . . . 3 3 . 1 . 027 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.553 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 29.3 Cg_exo -60.15 -41.27 53.03 Favored 'Trans proline' 0 N--CA 1.49 1.317 0 CA-C-N 121.492 1.569 . . . . 0.28 112.375 -178.008 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 50.6 m-85 -68.63 -48.52 63.86 Favored 'General case' 0 C--N 1.303 -1.445 0 O-C-N 120.797 -1.189 . . . . 0.37 109.534 179.886 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.1 t80 -60.91 -51.94 67.14 Favored 'General case' 0 C--N 1.3 -1.566 0 O-C-N 121.154 -0.967 . . . . 0.16 109.151 179.046 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 44.8 t60 -65.72 -43.31 89.48 Favored 'General case' 0 C--N 1.292 -1.892 0 O-C-N 121.691 -0.63 . . . . 0.32 110.747 179.634 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.5 m -62.77 -39.49 94.35 Favored 'General case' 0 N--CA 1.501 2.108 0 O-C-N 120.829 -1.169 . . . . 0.22 111.392 -179.653 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.7 -20.06 63.05 Favored 'General case' 0 N--CA 1.491 1.58 0 O-C-N 120.97 -1.082 . . . . 0.22 110.159 -178.201 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 54.5 m -53.98 -39.71 66.26 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 118.974 -1.09 . . . . 0.16 108.284 -179.96 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 72.9 mm-40 -83.07 -18.16 40.64 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.044 -1.035 . . . . 2.16 109.867 178.856 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.3 ttmt -76.85 -35.69 57.34 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 107.244 -1.391 . . . . 1.78 107.244 179.597 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 83.6 m-85 -123.8 67.11 1.03 Allowed 'General case' 0 N--CA 1.493 1.71 0 N-CA-C 107.405 -1.332 . . . . 0.25 107.405 178.183 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.3 p -64.28 -10.42 23.78 Favored 'General case' 0 N--CA 1.484 1.258 0 N-CA-C 108.868 -0.79 . . . . 0.22 108.868 -179.845 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 27.8 t30 -90.23 8.45 33.09 Favored 'General case' 0 N--CA 1.488 1.449 0 N-CA-C 108.04 -1.096 . . . . 1.13 108.04 179.161 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.418 HG13 ' HB3' ' A' ' 22' ' ' LEU . 40.3 t -127.16 143.65 39.84 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.51 0 N-CA-C 107.483 -1.303 . . . . 0.24 107.483 178.598 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.405 HG22 ' CD1' ' A' ' 55' ' ' LEU . 27.7 mm -98.99 121.22 49.32 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.898 0 O-C-N 121.222 -0.924 . . . . 0.15 109.614 -178.375 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.447 ' C ' HD12 ' A' ' 55' ' ' LEU . 49.3 m-85 -99.15 127.88 45.19 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.485 -0.76 . . . . 0.12 109.403 179.392 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.447 HD12 ' C ' ' A' ' 54' ' ' PHE . 2.8 mp -111.7 146.36 37.65 Favored 'General case' 0 N--CA 1.507 2.415 0 O-C-N 121.349 -0.845 . . . . 0.22 109.333 178.903 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 33.7 tt0 -116.04 129.83 56.54 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 106.775 -1.565 . . . . 1.13 106.775 177.778 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 98.8 t -126.79 132.78 69.73 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.913 0 CA-C-O 121.547 0.689 . . . . 0.15 109.827 -178.359 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.424 ' CG ' ' H ' ' A' ' 61' ' ' ASP . 53.7 t0 -97.98 118.92 35.66 Favored 'General case' 0 C--N 1.301 -1.514 0 N-CA-C 108.535 -0.913 . . . . 1.05 108.535 179.626 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.2 m -65.57 -20.87 28.16 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.678 0 O-C-N 120.252 -1.53 . . . . 0.16 108.247 179.292 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.524 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 3.4 m-20 -92.14 -41.51 10.43 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.517 -0.739 . . . . 1.08 112.406 -177.982 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.424 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 65.6 m-20 -95.49 -20.98 18.61 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 120.402 -1.436 . . . . 1.07 108.437 179.223 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -120.98 43.42 2.79 Favored 'General case' 0 N--CA 1.496 1.842 0 N-CA-C 108.238 -1.023 . . . . 0.14 108.238 179.258 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -61.56 -19.3 62.01 Favored 'General case' 0 N--CA 1.49 1.552 0 O-C-N 121.615 -0.678 . . . . 1.47 109.645 -179.144 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.651 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -62.8 -40.47 97.45 Favored 'General case' 0 N--CA 1.491 1.624 0 O-C-N 121.105 -0.997 . . . . 1.05 109.583 179.429 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.651 HG23 ' OD1' ' A' ' 64' ' ' ASP . 22.2 t -72.31 -43.45 64.86 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.632 0 O-C-N 121.244 -0.91 . . . . 0.35 109.69 -179.999 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.49 -39.16 74.33 Favored 'General case' 0 C--N 1.303 -1.441 0 O-C-N 121.647 -0.658 . . . . 0.26 111.371 -178.199 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 97.0 p -61.21 -36.0 78.71 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 120.983 -1.073 . . . . 0.24 109.191 -179.276 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.467 ' HB2' ' HZ1' ' A' ' 8' ' ' LYS . 14.1 tm-20 -64.97 -39.67 93.84 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.527 -0.733 . . . . 2.06 109.24 179.508 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.15 -3.2 58.72 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.204 -0.935 . . . . 0.23 110.791 -178.987 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.3 mm-40 55.51 50.31 14.88 Favored 'General case' 0 N--CA 1.494 1.769 0 O-C-N 121.002 -1.062 . . . . 2.02 109.746 -179.709 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 21.5 t -63.62 134.03 28.91 Favored 'Isoleucine or valine' 0 C--N 1.298 -1.674 0 C-N-CA 118.627 -1.229 . . . . 0.16 108.63 -179.049 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 45.5 mtmt -105.0 -12.72 16.04 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.67 -0.644 . . . . 1.6 110.23 -179.197 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.466 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -162.31 155.55 20.35 Favored 'General case' 0 N--CA 1.497 1.918 0 O-C-N 120.908 -1.12 . . . . 0.14 110.92 179.526 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.423 HG23 ' NE1' ' B' ' 67' ' ' TRP . 31.1 p -128.91 154.45 80.2 Favored Pre-proline 0 N--CA 1.499 1.983 0 N-CA-C 107.455 -1.313 . . . . 0.15 107.455 178.582 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.4 Cg_endo -76.91 143.17 74.92 Favored 'Cis proline' 0 N--CA 1.492 1.43 0 C-N-CA 123.985 -1.256 . . . . 0.16 112.854 -1.565 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.402 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 93.0 m -130.0 134.75 47.63 Favored 'General case' 0 N--CA 1.496 1.873 0 N-CA-C 109.044 -0.724 . . . . 0.13 109.044 178.55 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 94.3 m-85 -110.58 130.16 55.63 Favored 'General case' 0 C--N 1.297 -1.68 0 CA-C-O 121.378 0.608 . . . . 0.2 109.777 -179.385 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 72.3 mt-30 -120.98 139.94 52.58 Favored 'General case' 0 N--CA 1.494 1.775 0 N-CA-C 108.189 -1.041 . . . . 0.29 108.189 179.29 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 72.4 m-85 -105.84 134.97 48.11 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.669 -0.644 . . . . 0.14 110.126 -178.94 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 76.8 m-85 -129.45 145.85 51.37 Favored 'General case' 0 N--CA 1.489 1.515 0 CA-C-O 121.709 0.766 . . . . 0.15 109.577 179.266 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 68.0 tttt -149.09 131.18 15.37 Favored 'General case' 0 C--N 1.298 -1.644 0 N-CA-C 106.372 -1.714 . . . . 1.68 106.372 179.072 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 78.6 mttt 57.33 30.08 17.92 Favored 'General case' 0 N--CA 1.501 2.086 0 O-C-N 121.186 -0.946 . . . . 1.22 109.575 -178.766 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 75.56 18.31 79.84 Favored Glycine 0 N--CA 1.492 2.389 0 N-CA-C 110.451 -1.06 . . . . 0.23 110.451 178.989 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.2 mt-30 -127.52 142.88 51.27 Favored 'General case' 0 N--CA 1.497 1.912 0 O-C-N 121.388 -1.066 . . . . 2.07 109.654 -179.955 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 3.1 ttmp? -80.06 131.55 35.79 Favored 'General case' 0 N--CA 1.493 1.713 0 O-C-N 121.432 -0.792 . . . . 1.82 109.324 179.572 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 23.1 m -121.8 11.24 5.89 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.754 0 O-C-N 121.814 -0.554 . . . . 0.3 110.374 -179.638 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 167.49 161.54 17.18 Favored Glycine 0 N--CA 1.498 2.805 0 C-N-CA 118.42 -1.848 . . . . 0.17 112.012 179.353 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.6 tm-20 -165.32 149.23 8.45 Favored 'General case' 0 N--CA 1.489 1.504 0 O-C-N 121.872 -0.781 . . . . 1.93 110.198 -179.865 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.443 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 12.1 p90 -162.84 160.59 25.3 Favored 'General case' 0 N--CA 1.5 2.041 0 O-C-N 121.078 -1.014 . . . . 0.14 109.135 177.876 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -126.29 164.9 20.0 Favored 'General case' 0 N--CA 1.496 1.854 0 CA-C-O 121.492 0.663 . . . . 0.12 109.932 -178.914 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.483 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.74 142.38 6.68 Favored Glycine 0 N--CA 1.492 2.426 0 N-CA-C 109.072 -1.611 . . . . 0.12 109.072 179.862 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.409 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -78.78 62.96 3.41 Favored 'General case' 0 C--N 1.301 -1.519 0 O-C-N 121.272 -1.134 . . . . 0.18 109.495 -179.82 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.72 97.37 5.94 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.475 -0.766 . . . . 0.88 109.015 179.398 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.96 -32.66 72.4 Favored 'General case' 0 N--CA 1.494 1.754 0 O-C-N 121.332 -0.855 . . . . 1.06 111.265 -179.704 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.87 -30.04 71.17 Favored 'General case' 0 N--CA 1.491 1.621 0 O-C-N 121.044 -1.035 . . . . 1.61 109.934 179.941 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 75.1 tttt -61.23 -35.95 78.64 Favored 'General case' 0 C--N 1.297 -1.691 0 CA-C-O 121.626 0.727 . . . . 1.45 109.206 -179.1 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 69.9 mt -59.52 -39.43 83.84 Favored 'General case' 0 C--N 1.303 -1.431 0 CA-C-O 122.253 1.025 . . . . 0.19 108.968 179.356 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 86.6 tt0 -62.43 -43.07 99.69 Favored 'General case' 0 C--N 1.289 -2.031 0 C-N-CA 119.824 -0.75 . . . . 2.1 110.745 -177.797 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.02 -44.15 69.87 Favored 'General case' 0 N--CA 1.491 1.605 0 O-C-N 120.951 -1.093 . . . . 0.19 111.031 -178.867 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 22.3 m -63.97 -40.16 95.77 Favored 'General case' 0 N--CA 1.493 1.699 0 O-C-N 121.206 -0.934 . . . . 0.2 109.874 -178.714 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 67.7 mt -61.29 -50.02 82.18 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 N-CA-C 107.849 -1.167 . . . . 0.16 107.849 178.784 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.471 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.2 t-20 -60.26 -35.08 74.68 Favored 'General case' 0 C--N 1.301 -1.503 0 N-CA-C 108.693 -0.855 . . . . 0.95 108.693 178.945 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 8.6 tm-20 -67.65 -38.57 84.0 Favored 'General case' 0 C--N 1.298 -1.643 0 O-C-N 121.418 -0.801 . . . . 2.21 109.881 -178.639 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.646 ' HB2' HD11 ' A' ' 22' ' ' LEU . 84.0 mt -99.21 -4.16 32.68 Favored 'General case' 0 N--CA 1.504 2.232 0 O-C-N 121.065 -1.022 . . . . 0.25 111.405 -179.463 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.471 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.1 p . . . . . 0 N--CA 1.496 1.868 0 O-C-N 120.538 -1.351 . . . . 1.08 109.164 -179.177 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_exo . . . . . 0 N--CA 1.493 1.494 0 CA-C-O 121.312 0.463 . . . . 1.46 112.204 . . . . . . . . . 0 0 . 1 . 027 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -90.8 125.46 35.72 Favored 'General case' 0 N--CA 1.493 1.718 0 O-C-N 121.205 -0.934 . . . . 0.88 109.387 -179.9 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.439 HG22 ' H ' ' B' ' 63' ' ' LYS . 59.0 m -110.41 130.37 55.57 Favored 'General case' 0 N--CA 1.503 2.203 0 O-C-N 121.34 -0.85 . . . . 0.7 109.375 179.96 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 73.2 mt -65.4 -32.19 73.69 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.153 -0.967 . . . . 0.61 109.949 -179.811 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.439 ' H ' HG22 ' B' ' 61' ' ' THR . 63.7 mmtt -64.18 -19.99 65.7 Favored 'General case' 0 N--CA 1.49 1.567 0 O-C-N 121.215 -0.928 . . . . 1.31 109.536 -179.134 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.483 HD11 ' HA2' ' A' ' 91' ' ' GLY . 35.3 mm -130.28 139.88 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.489 0 O-C-N 121.856 -0.528 . . . . 0.15 110.404 -179.541 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.6 m -98.17 125.38 43.17 Favored 'General case' 0 N--CA 1.502 2.134 0 N-CA-C 107.524 -1.287 . . . . 0.19 107.524 177.334 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.8 m -77.93 145.07 36.34 Favored 'General case' 0 N--CA 1.499 2.011 0 O-C-N 120.831 -1.168 . . . . 0.2 111.689 -178.348 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.466 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 24.6 m95 -76.7 -12.02 59.93 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.411 -0.805 . . . . 0.21 108.976 178.931 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.7 m120 -51.34 -13.05 0.17 Allowed 'General case' 0 N--CA 1.491 1.622 0 O-C-N 121.031 -1.043 . . . . 0.49 108.485 179.654 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.463 ' N ' ' C ' ' B' ' 67' ' ' TRP . 19.0 m -61.33 145.92 12.33 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.511 0 O-C-N 121.17 -0.957 . . . . 1.04 109.79 179.781 . . . . . . . . 2 2 . 1 . 027 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 60.4 m-20 -61.01 -37.67 83.35 Favored 'General case' 0 C--N 1.302 -1.488 0 O-C-N 121.433 -0.792 . . . . 1.36 109.208 -179.423 . . . . . . . . 1 1 . 1 . 027 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.493 2.458 0 CA-C-O 117.897 -1.502 . . . . 2.32 109.842 -179.864 . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 22.9 ptp . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.736 -0.468 . . . . 2.88 109.736 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 69.8 t -97.99 153.71 3.95 Favored 'Isoleucine or valine' 0 N--CA 1.507 2.424 0 O-C-N 121.373 -0.83 . . . . 0.45 109.465 -179.526 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -131.33 130.11 42.29 Favored 'General case' 0 N--CA 1.5 2.028 0 O-C-N 121.382 -0.823 . . . . 1.67 108.889 179.889 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.4 tt0 -95.96 124.22 39.88 Favored 'General case' 0 N--CA 1.495 1.791 0 O-C-N 120.888 -1.132 . . . . 0.31 108.595 178.74 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 31.4 mm -102.0 112.03 33.78 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.815 0 O-C-N 121.341 -0.849 . . . . 0.19 109.329 179.57 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.48 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.1 mp0 -97.21 -1.0 45.84 Favored 'General case' 0 N--CA 1.49 1.573 0 O-C-N 121.186 -0.946 . . . . 2.25 109.372 179.836 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.5 p -154.87 157.62 38.11 Favored 'General case' 0 N--CA 1.501 2.079 0 O-C-N 120.59 -1.319 . . . . 0.15 111.208 179.738 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.419 ' NZ ' ' OE2' ' A' ' 68' ' ' GLU . 34.4 ttmt -63.88 -32.48 74.01 Favored 'General case' 0 N--CA 1.489 1.519 0 N-CA-C 108.017 -1.105 . . . . 1.65 108.017 177.648 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.4 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 52.1 m -56.28 -46.43 79.74 Favored 'General case' 0 C--N 1.303 -1.43 0 C-N-CA 119.319 -0.952 . . . . 0.23 108.841 -178.82 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -70.59 -30.25 66.88 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.256 -0.902 . . . . 0.17 109.166 178.745 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.51 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.8 t80 -59.86 -43.81 94.47 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.397 -0.815 . . . . 0.14 108.974 -179.025 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.2 mm-40 -65.55 -42.96 91.31 Favored 'General case' 0 C--N 1.299 -1.592 0 CA-C-O 121.693 0.759 . . . . 1.31 109.819 -179.656 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.555 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.3 OUTLIER -66.52 -39.7 88.79 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.556 -0.715 . . . . 1.77 110.06 179.638 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -64.26 -42.9 96.26 Favored 'General case' 0 C--N 1.302 -1.482 0 O-C-N 121.304 -0.872 . . . . 0.15 108.696 -179.755 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.51 HD11 ' CE2' ' A' ' 11' ' ' PHE . 65.4 mt -59.92 -40.25 88.23 Favored 'General case' 0 C--N 1.301 -1.538 0 O-C-N 121.219 -0.926 . . . . 0.17 108.597 179.673 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 9.9 t0 -69.39 -36.33 76.68 Favored 'General case' 0 N--CA 1.488 1.429 0 O-C-N 121.181 -0.95 . . . . 1.07 110.009 179.865 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -67.6 -39.31 84.8 Favored 'General case' 0 N--CA 1.496 1.841 0 O-C-N 121.343 -0.848 . . . . 0.18 110.516 -178.887 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.07 -32.45 70.96 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.228 -0.92 . . . . 0.17 108.966 -179.874 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.55 -124.02 17.59 Favored Glycine 0 N--CA 1.488 2.136 0 N-CA-C 109.968 -1.253 . . . . 0.2 109.968 -179.649 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.6 m-20 -93.43 5.31 52.0 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.32 -1.106 . . . . 1.07 110.505 -179.073 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.9 mttt -76.55 149.28 36.67 Favored 'General case' 0 N--CA 1.492 1.631 0 O-C-N 121.157 -0.964 . . . . 1.5 109.173 -179.728 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.682 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.5 OUTLIER -60.31 157.73 13.05 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 106.861 -1.533 . . . . 0.47 106.861 179.795 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.663 ' H ' HD23 ' A' ' 22' ' ' LEU . 99.5 t -143.95 112.39 1.77 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.475 0 O-C-N 121.049 -1.032 . . . . 0.17 108.685 -179.9 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 22.7 t -100.17 144.68 12.08 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.576 0 N-CA-C 108.443 -0.947 . . . . 0.14 108.443 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.416 ' CG1' HG21 ' A' ' 57' ' ' VAL . 21.4 t -126.4 121.09 58.12 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.25 0 O-C-N 121.273 -0.892 . . . . 0.13 109.796 -179.917 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.519 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.0 t70 -98.66 120.08 38.49 Favored 'General case' 0 N--CA 1.502 2.173 0 O-C-N 121.217 -0.927 . . . . 1.05 109.872 179.545 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.6 m-85 -96.3 23.27 6.82 Favored 'General case' 0 N--CA 1.501 2.103 0 O-C-N 121.342 -0.849 . . . . 0.73 110.059 179.641 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.469 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 54.3 m -58.67 147.36 33.06 Favored 'General case' 0 C--N 1.296 -1.755 0 O-C-N 121.054 -1.029 . . . . 0.3 110.746 -178.788 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.555 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.76 125.57 32.68 Favored 'General case' 0 N--CA 1.486 1.373 0 N-CA-C 107.94 -1.133 . . . . 0.22 107.94 178.669 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . 0.401 HG22 ' OD1' ' A' ' 58' ' ' ASP . 8.9 t -67.98 -33.91 75.53 Favored 'General case' 0 C--N 1.299 -1.593 0 C-N-CA 118.957 -1.097 . . . . 0.3 108.573 -179.887 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.555 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 57.0 p-90 -70.42 -23.93 62.83 Favored 'General case' 0 N--CA 1.498 1.929 0 O-C-N 121.322 -0.861 . . . . 0.26 110.387 179.396 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.4 t -81.46 119.83 24.23 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 120.599 -1.313 . . . . 0.26 107.486 -179.873 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.47 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -64.7 -51.29 53.09 Favored Glycine 0 N--CA 1.49 2.243 0 C-N-CA 120.3 -0.952 . . . . 0.23 110.737 -178.152 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.47 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.8 Cg_exo -51.8 -36.34 62.23 Favored 'Trans proline' 0 N--CA 1.492 1.387 0 CA-C-N 118.553 1.176 . . . . 0.31 112.504 179.79 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.469 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.46 -48.86 16.08 Favored 'General case' 0 N--CA 1.493 1.722 0 O-C-N 121.147 -0.97 . . . . 0.24 109.883 179.918 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -60.6 -34.91 74.93 Favored 'General case' 0 N--CA 1.497 1.91 0 O-C-N 121.119 -0.988 . . . . 1.59 109.465 179.309 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.509 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -60.01 -28.95 68.15 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.568 -0.708 . . . . 2.1 109.955 -179.28 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.547 HG22 ' O ' ' A' ' 38' ' ' ILE . 68.2 mt -83.31 -0.14 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.714 0 O-C-N 121.753 -0.592 . . . . 0.49 110.379 -178.939 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.55 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.66 -30.26 6.22 Favored Pre-proline 0 N--CA 1.489 1.487 0 O-C-N 120.674 -1.266 . . . . 0.8 113.051 -179.047 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.55 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.9 Cg_exo -59.76 -42.9 41.95 Favored 'Trans proline' 0 N--CA 1.495 1.562 0 CA-C-N 121.699 1.643 . . . . 0.28 113.333 -177.507 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 55.1 m-85 -67.91 -47.87 67.57 Favored 'General case' 0 N--CA 1.492 1.652 0 O-C-N 120.432 -1.417 . . . . 0.37 108.561 179.908 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 92.3 t80 -59.84 -51.53 69.32 Favored 'General case' 0 C--N 1.297 -1.686 0 O-C-N 121.296 -0.878 . . . . 0.16 110.104 179.174 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 40.6 t60 -69.37 -44.42 71.57 Favored 'General case' 0 C--N 1.296 -1.74 0 O-C-N 121.801 -0.562 . . . . 0.32 111.092 -179.83 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.432 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 61.1 m -61.39 -39.96 92.61 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.147 -0.971 . . . . 0.22 110.332 -179.263 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 32.0 mt -59.59 -24.28 63.64 Favored 'General case' 0 N--CA 1.492 1.675 0 O-C-N 121.12 -0.987 . . . . 0.22 110.113 -178.801 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 69.8 m -51.83 -36.53 48.36 Favored 'General case' 0 C--N 1.298 -1.636 0 O-C-N 120.648 -1.283 . . . . 0.16 108.957 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 31.7 mp0 -86.14 -14.34 44.41 Favored 'General case' 0 C--N 1.302 -1.459 0 O-C-N 121.116 -0.99 . . . . 2.16 109.43 179.178 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.7 tttt -80.38 -34.24 36.52 Favored 'General case' 0 N--CA 1.489 1.48 0 N-CA-C 107.064 -1.458 . . . . 1.78 107.064 178.049 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 79.8 m-85 -124.79 64.25 1.12 Allowed 'General case' 0 N--CA 1.497 1.912 0 N-CA-C 107.372 -1.344 . . . . 0.25 107.372 177.767 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 68.4 p -61.52 -9.7 6.34 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.542 -0.724 . . . . 0.22 109.27 -179.271 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 30.4 t30 -91.6 9.83 30.58 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 108.336 -0.987 . . . . 1.13 108.336 179.216 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.52 HG13 ' HB3' ' A' ' 22' ' ' LEU . 47.8 t -127.39 142.11 44.49 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.413 0 N-CA-C 106.683 -1.599 . . . . 0.24 106.683 178.575 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.2 mm -99.79 119.61 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.006 0 O-C-N 121.053 -1.029 . . . . 0.15 109.425 -178.424 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.524 ' C ' HD12 ' A' ' 55' ' ' LEU . 30.0 m-85 -99.07 124.43 44.07 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 121.309 -0.87 . . . . 0.12 110.293 179.645 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.524 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.7 mp -109.16 141.43 41.38 Favored 'General case' 0 N--CA 1.504 2.274 0 O-C-N 121.168 -0.958 . . . . 0.22 109.095 178.855 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -110.02 132.35 54.24 Favored 'General case' 0 N--CA 1.493 1.69 0 N-CA-C 106.925 -1.509 . . . . 1.13 106.925 178.101 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.416 HG21 ' CG1' ' A' ' 25' ' ' VAL . 40.9 t -128.38 132.54 68.04 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.127 0 O-C-N 121.476 -0.765 . . . . 0.15 110.416 -177.894 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.494 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 27.8 t0 -95.81 119.6 34.58 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.458 -0.776 . . . . 1.05 109.044 179.55 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.3 m -67.59 -16.57 21.28 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.61 0 O-C-N 120.469 -1.394 . . . . 0.16 108.598 179.521 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.452 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.6 m-20 -92.11 -42.91 9.67 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.449 -0.782 . . . . 1.08 111.506 -178.656 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 42.0 m-20 -97.32 -23.4 16.14 Favored 'General case' 0 N--CA 1.503 2.182 0 O-C-N 120.869 -1.144 . . . . 1.07 108.638 179.98 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.494 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -114.08 36.36 3.74 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.828 -1.545 . . . . 0.14 106.828 179.191 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . 0.541 ' N ' ' OE1' ' A' ' 63' ' ' GLN . 0.3 OUTLIER -59.67 -20.53 56.85 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.657 -0.702 . . . . 1.47 110.037 -178.736 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.651 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -67.13 -37.43 83.84 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 120.98 -1.075 . . . . 1.05 109.201 179.96 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.651 HG23 ' OD1' ' A' ' 64' ' ' ASP . 19.0 t -72.89 -43.54 59.59 Favored 'Isoleucine or valine' 0 C--N 1.304 -1.395 0 O-C-N 121.212 -0.93 . . . . 0.35 109.279 179.91 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.77 -40.04 72.87 Favored 'General case' 0 C--N 1.302 -1.468 0 O-C-N 121.71 -0.619 . . . . 0.26 110.849 -178.464 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 96.2 p -60.98 -35.41 76.73 Favored 'General case' 0 N--CA 1.489 1.523 0 O-C-N 120.514 -1.366 . . . . 0.24 108.864 179.968 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.419 ' OE2' ' NZ ' ' A' ' 8' ' ' LYS . 36.9 tt0 -62.22 -39.59 93.29 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.448 -0.782 . . . . 2.06 109.401 178.796 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -85.74 -2.56 58.33 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.28 -0.887 . . . . 0.23 110.767 -179.299 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 81.0 mm-40 55.57 49.16 17.14 Favored 'General case' 0 N--CA 1.497 1.886 0 O-C-N 121.214 -0.929 . . . . 2.02 109.133 -179.385 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 22.1 t -62.74 131.83 28.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.795 0 C-N-CA 118.267 -1.373 . . . . 0.16 108.397 -178.96 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.1 mmtt -102.85 -12.42 17.57 Favored 'General case' 0 C--N 1.305 -1.344 0 O-C-N 121.668 -0.645 . . . . 1.6 109.828 -178.983 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.467 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.22 155.93 18.67 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.704 -1.247 . . . . 0.14 110.588 179.687 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -128.47 153.77 79.28 Favored Pre-proline 0 N--CA 1.5 2.071 0 N-CA-C 107.796 -1.187 . . . . 0.15 107.796 178.642 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.4 Cg_endo -76.51 141.07 68.82 Favored 'Cis proline' 0 N--CA 1.491 1.326 0 C-N-CA 123.797 -1.335 . . . . 0.16 113.331 -2.115 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.467 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.2 m -125.72 135.16 51.77 Favored 'General case' 0 N--CA 1.497 1.918 0 N-CA-C 108.246 -1.02 . . . . 0.13 108.246 177.918 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.749 ' CD2' HD21 ' A' ' 97' ' ' LEU . 89.7 m-85 -111.21 132.48 54.29 Favored 'General case' 0 N--CA 1.495 1.776 0 N-CA-C 108.801 -0.815 . . . . 0.2 108.801 179.796 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 73.7 mt-30 -123.35 141.86 51.55 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.134 -0.979 . . . . 0.29 108.696 179.573 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.4 ' CE1' HG21 ' A' ' 100' ' ' THR . 90.1 m-85 -109.02 131.45 55.06 Favored 'General case' 0 C--N 1.3 -1.581 0 CA-C-O 121.588 0.709 . . . . 0.14 111.19 -178.504 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -126.57 145.66 50.45 Favored 'General case' 0 N--CA 1.49 1.566 0 CA-C-O 121.395 0.617 . . . . 0.15 109.511 178.981 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 75.3 tttt -147.98 130.39 15.73 Favored 'General case' 0 C--N 1.297 -1.713 0 N-CA-C 107.368 -1.345 . . . . 1.68 107.368 179.409 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 71.3 mttt 57.45 29.45 17.02 Favored 'General case' 0 N--CA 1.495 1.819 0 O-C-N 121.223 -0.923 . . . . 1.22 108.841 -178.893 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 76.66 18.23 79.17 Favored Glycine 0 N--CA 1.49 2.248 0 C-N-CA 120.026 -1.083 . . . . 0.23 110.557 179.811 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 29.6 mt-30 -126.82 140.75 52.13 Favored 'General case' 0 N--CA 1.503 2.2 0 O-C-N 121.185 -1.185 . . . . 2.07 110.467 179.907 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.4 tttt -79.64 129.73 34.74 Favored 'General case' 0 N--CA 1.495 1.779 0 O-C-N 121.412 -0.805 . . . . 1.82 108.869 179.198 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 16.5 m -125.43 3.91 4.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.896 0 O-C-N 121.588 -0.695 . . . . 0.3 110.187 -179.897 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -178.89 156.97 20.05 Favored Glycine 0 N--CA 1.496 2.634 0 C-N-CA 118.108 -1.996 . . . . 0.17 111.984 -179.477 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.5 tm-20 -165.99 149.62 7.73 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.977 -0.719 . . . . 1.93 109.719 179.11 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.432 ' C ' ' CD1' ' A' ' 89' ' ' PHE . 17.6 p90 -164.1 160.85 22.01 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 119.186 -1.005 . . . . 0.14 109.404 177.447 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.1 p -126.02 160.75 29.23 Favored 'General case' 0 N--CA 1.501 2.096 0 O-C-N 121.647 -0.658 . . . . 0.12 109.901 -179.614 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.493 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 120.91 138.89 5.61 Favored Glycine 0 N--CA 1.494 2.508 0 N-CA-C 108.931 -1.668 . . . . 0.12 108.931 179.885 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.543 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -77.71 65.5 3.21 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 121.214 -1.168 . . . . 0.18 110.711 -178.889 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.436 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 22.2 t-20 -118.03 101.66 8.43 Favored 'General case' 0 N--CA 1.499 2.013 0 N-CA-C 108.273 -1.01 . . . . 0.88 108.273 178.109 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' H ' ' HD3' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.4 -33.2 72.66 Favored 'General case' 0 C--N 1.297 -1.682 0 O-C-N 121.332 -0.855 . . . . 1.06 111.3 -179.398 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.8 mm-40 -63.8 -29.92 71.07 Favored 'General case' 0 N--CA 1.491 1.589 0 O-C-N 120.868 -1.145 . . . . 1.61 109.575 179.905 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.436 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 79.2 tttt -62.79 -33.99 76.35 Favored 'General case' 0 C--N 1.299 -1.614 0 O-C-N 121.637 -0.665 . . . . 1.45 109.392 -179.097 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.749 HD21 ' CD2' ' A' ' 77' ' ' PHE . 39.7 mt -59.86 -39.91 86.83 Favored 'General case' 0 C--N 1.3 -1.573 0 N-CA-C 108.53 -0.915 . . . . 0.19 108.53 179.733 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 88.9 tt0 -63.05 -42.44 99.72 Favored 'General case' 0 C--N 1.297 -1.715 0 C-N-CA 119.428 -0.909 . . . . 2.1 110.523 -178.451 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -67.86 -44.38 77.26 Favored 'General case' 0 N--CA 1.493 1.695 0 O-C-N 120.949 -1.094 . . . . 0.19 111.123 -178.412 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.4 HG21 ' CE1' ' A' ' 79' ' ' PHE . 24.5 m -65.98 -39.93 90.76 Favored 'General case' 0 C--N 1.302 -1.483 0 O-C-N 120.61 -1.306 . . . . 0.2 108.599 -179.822 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 76.8 mt -64.01 -47.0 92.31 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.756 0 N-CA-C 107.396 -1.335 . . . . 0.16 107.396 177.923 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.488 ' O ' HG12 ' A' ' 105' ' ' VAL . 1.0 OUTLIER -60.74 -36.77 79.73 Favored 'General case' 0 C--N 1.302 -1.486 0 N-CA-C 108.504 -0.924 . . . . 0.95 108.504 179.047 . . . . . . . . 3 3 . 1 . 028 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.3 tm-20 -68.27 -39.72 82.07 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.759 -0.588 . . . . 2.21 109.878 -179.174 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.682 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.1 mt -98.33 -2.75 38.65 Favored 'General case' 0 N--CA 1.499 2.007 0 O-C-N 121.429 -0.794 . . . . 0.25 111.661 -178.632 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.488 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.9 p . . . . . 0 N--CA 1.499 1.978 0 O-C-N 120.535 -1.353 . . . . 1.08 109.391 -179.119 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_exo . . . . . 0 N--CA 1.495 1.562 0 CA-C-O 121.047 0.353 . . . . 1.46 112.3 . . . . . . . . . 0 0 . 1 . 028 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -85.62 124.04 31.71 Favored 'General case' 0 N--CA 1.492 1.674 0 O-C-N 121.053 -1.029 . . . . 0.88 108.777 179.842 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 26.9 m -106.12 129.98 54.1 Favored 'General case' 0 N--CA 1.5 2.05 0 O-C-N 121.478 -0.764 . . . . 0.7 109.225 -179.689 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.8 mt -65.87 -30.11 70.66 Favored 'General case' 0 N--CA 1.495 1.787 0 O-C-N 121.373 -0.829 . . . . 0.61 109.67 -179.709 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 63.0 mmtt -61.48 -20.32 63.02 Favored 'General case' 0 N--CA 1.495 1.785 0 O-C-N 121.428 -0.795 . . . . 1.31 109.688 -179.817 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.493 HD11 ' HA2' ' A' ' 91' ' ' GLY . 33.4 mm -129.88 140.19 49.62 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.481 0 O-C-N 121.583 -0.698 . . . . 0.15 109.463 -179.776 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 26.8 m -96.38 127.08 42.05 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 106.896 -1.52 . . . . 0.19 106.896 177.853 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 53.7 m -76.89 141.14 40.68 Favored 'General case' 0 N--CA 1.501 2.087 0 O-C-N 120.958 -1.089 . . . . 0.2 111.123 -178.042 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.462 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 23.7 m95 -77.18 -11.87 59.87 Favored 'General case' 0 N--CA 1.498 1.953 0 O-C-N 121.009 -1.057 . . . . 0.21 109.32 178.974 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.428 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.2 m120 -54.22 -10.94 0.42 Allowed 'General case' 0 C--N 1.301 -1.504 0 N-CA-C 108.636 -0.876 . . . . 0.49 108.636 179.583 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.443 ' N ' ' C ' ' B' ' 67' ' ' TRP . 19.2 m -65.35 144.13 15.08 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.405 0 O-C-N 121.483 -0.761 . . . . 1.04 109.27 179.678 . . . . . . . . 2 2 . 1 . 028 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 66.5 m-20 -59.45 -39.19 82.79 Favored 'General case' 0 C--N 1.301 -1.53 0 O-C-N 121.126 -0.984 . . . . 1.36 109.084 179.329 . . . . . . . . 1 1 . 1 . 028 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.209 0 N-CA-C 109.079 -1.608 . . . . 2.32 109.079 -179.426 . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 77.6 mmm . . . . . 0 N--CA 1.49 1.571 0 N-CA-C 108.887 -0.782 . . . . 2.88 108.887 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 79.5 t -99.24 144.3 12.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.022 0 O-C-N 121.267 -0.896 . . . . 0.45 109.544 -179.833 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 9.5 tppt? -129.94 129.17 43.48 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 108.414 -0.958 . . . . 1.67 108.414 -179.721 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 60.1 tt0 -98.95 123.07 42.98 Favored 'General case' 0 N--CA 1.495 1.815 0 N-CA-C 108.659 -0.867 . . . . 0.31 108.659 179.454 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 25.6 mm -100.81 114.16 38.96 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.609 0 N-CA-C 108.761 -0.829 . . . . 0.19 108.761 179.38 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.496 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 56.0 mp0 -97.22 -0.12 47.29 Favored 'General case' 0 N--CA 1.488 1.462 0 O-C-N 121.241 -0.912 . . . . 2.25 109.751 -179.724 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.0 p -153.22 156.28 38.21 Favored 'General case' 0 N--CA 1.499 1.976 0 O-C-N 120.812 -1.18 . . . . 0.15 111.271 -179.666 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 33.2 ttmt -64.67 -30.92 71.95 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 108.13 -1.063 . . . . 1.65 108.13 178.323 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 45.1 m -58.21 -49.43 77.09 Favored 'General case' 0 C--N 1.303 -1.414 0 C-N-CA 119.612 -0.835 . . . . 0.23 108.863 -179.246 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.03 -29.48 67.65 Favored 'General case' 0 C--N 1.301 -1.517 0 O-C-N 121.43 -0.794 . . . . 0.17 109.079 178.994 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.456 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.6 t80 -59.71 -44.15 93.82 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.202 -0.936 . . . . 0.14 109.136 -179.834 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 94.4 mm-40 -66.93 -42.94 84.47 Favored 'General case' 0 C--N 1.296 -1.733 0 C-N-CA 119.778 -0.769 . . . . 1.31 108.932 -179.942 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.0 mm-40 -64.13 -36.55 84.42 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.519 -0.738 . . . . 1.77 110.352 179.569 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.03 -42.83 79.99 Favored 'General case' 0 C--N 1.302 -1.489 0 O-C-N 121.375 -0.828 . . . . 0.15 109.061 -179.36 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.456 HD11 ' CE2' ' A' ' 11' ' ' PHE . 80.3 mt -60.86 -39.99 91.22 Favored 'General case' 0 C--N 1.303 -1.434 0 O-C-N 121.299 -0.876 . . . . 0.17 108.662 179.612 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 34.4 t0 -69.7 -36.4 75.91 Favored 'General case' 0 N--CA 1.488 1.457 0 O-C-N 121.425 -0.797 . . . . 1.07 109.632 179.436 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.16 -36.82 80.25 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.435 -0.791 . . . . 0.18 110.269 -179.314 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.03 -27.53 69.47 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.139 -0.975 . . . . 0.17 109.534 -179.712 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.29 -129.47 28.74 Favored Glycine 0 N--CA 1.49 2.291 0 N-CA-C 109.861 -1.295 . . . . 0.2 109.861 179.952 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 70.5 m-20 -93.09 7.53 43.8 Favored 'General case' 0 N--CA 1.495 1.788 0 O-C-N 121.284 -1.127 . . . . 1.07 110.473 -179.112 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.5 mttp -75.6 149.92 38.16 Favored 'General case' 0 N--CA 1.496 1.833 0 O-C-N 121.018 -1.051 . . . . 1.5 109.453 -179.968 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.65 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.08 153.92 20.57 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 107.216 -1.402 . . . . 0.47 107.216 179.73 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.65 ' H ' HD23 ' A' ' 22' ' ' LEU . 63.8 t -143.29 117.38 3.81 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.434 0 O-C-N 121.002 -1.061 . . . . 0.17 108.531 179.954 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 41.6 t -104.36 139.27 25.81 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.526 0 N-CA-C 108.055 -1.091 . . . . 0.14 108.055 179.573 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 97.5 t -121.68 123.16 68.8 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.11 0 O-C-N 121.401 -0.812 . . . . 0.13 108.941 -179.783 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.545 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 37.9 t70 -102.75 110.01 21.79 Favored 'General case' 0 N--CA 1.494 1.766 0 O-C-N 121.649 -0.657 . . . . 1.05 110.924 -179.521 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -90.1 103.79 16.43 Favored 'General case' 0 N--CA 1.491 1.604 0 N-CA-C 106.748 -1.575 . . . . 0.73 106.748 176.923 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 63.8 m -130.02 146.97 51.72 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 108.705 -0.85 . . . . 0.3 108.705 179.793 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.706 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.48 121.6 28.41 Favored 'General case' 0 C--N 1.295 -1.773 0 N-CA-C 107.571 -1.27 . . . . 0.22 107.571 179.259 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.8 t -65.69 -32.36 73.88 Favored 'General case' 0 C--N 1.302 -1.47 0 C-N-CA 118.514 -1.274 . . . . 0.3 107.618 179.801 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.706 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 60.4 p-90 -70.27 -25.75 63.5 Favored 'General case' 0 N--CA 1.493 1.696 0 O-C-N 121.513 -0.742 . . . . 0.26 110.809 179.147 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.42 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 5.9 t -83.12 116.85 22.51 Favored 'General case' 0 N--CA 1.492 1.639 0 O-C-N 120.812 -1.18 . . . . 0.26 108.458 -179.318 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.453 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -60.67 -52.0 55.18 Favored Glycine 0 N--CA 1.49 2.262 0 C-N-CA 120.724 -0.75 . . . . 0.23 111.45 -178.425 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.453 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.1 Cg_exo -53.23 -33.19 63.87 Favored 'Trans proline' 0 C--N 1.311 -1.447 0 CA-C-N 118.497 1.148 . . . . 0.31 112.183 -179.568 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -77.08 -52.76 8.76 Favored 'General case' 0 N--CA 1.491 1.599 0 O-C-N 121.208 -0.932 . . . . 0.24 109.865 179.935 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.5 tttt -60.13 -36.73 78.14 Favored 'General case' 0 N--CA 1.494 1.768 0 O-C-N 121.03 -1.044 . . . . 1.59 109.611 179.645 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . . . . . . . . . 36.7 tpp -59.65 -28.1 66.94 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 121.457 -0.777 . . . . 2.1 109.914 -179.49 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.57 HG22 ' O ' ' A' ' 38' ' ' ILE . 76.9 mt -80.22 -4.01 6.88 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.878 0 O-C-N 121.5 -0.75 . . . . 0.49 110.781 -179.77 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.514 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -61.02 -29.94 6.14 Favored Pre-proline 0 N--CA 1.497 1.912 0 O-C-N 120.371 -1.456 . . . . 0.8 114.47 -177.711 . . . . . . . . 3 3 . 1 . 029 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.514 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 39.5 Cg_exo -59.22 -40.55 68.04 Favored 'Trans proline' 0 N--CA 1.498 1.766 0 CA-C-N 122.039 1.764 . . . . 0.28 113.506 -177.452 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -68.1 -47.22 68.8 Favored 'General case' 0 C--N 1.298 -1.635 0 C-N-CA 118.295 -1.362 . . . . 0.37 108.74 -179.976 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.8 t80 -62.64 -50.77 69.91 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.391 -0.818 . . . . 0.16 109.73 179.126 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.9 t60 -66.77 -41.33 87.9 Favored 'General case' 0 C--N 1.302 -1.498 0 O-C-N 121.602 -0.686 . . . . 0.32 110.441 -179.517 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.414 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 68.2 m -63.03 -37.73 88.36 Favored 'General case' 0 N--CA 1.495 1.786 0 O-C-N 121.236 -0.915 . . . . 0.22 110.652 -179.859 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -62.07 -25.72 67.85 Favored 'General case' 0 N--CA 1.49 1.54 0 O-C-N 121.174 -0.953 . . . . 0.22 110.285 -178.609 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 53.6 m -51.44 -39.45 57.4 Favored 'General case' 0 N--CA 1.489 1.48 0 O-C-N 120.981 -1.075 . . . . 0.16 108.577 -179.359 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 25.6 mp0 -84.48 -16.72 41.49 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 121.469 -0.769 . . . . 2.16 109.366 179.955 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 61.1 tttm -78.89 -36.62 41.82 Favored 'General case' 0 N--CA 1.496 1.84 0 O-C-N 120.776 -1.202 . . . . 1.78 108.179 179.659 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -123.96 66.17 1.04 Allowed 'General case' 0 N--CA 1.499 1.997 0 N-CA-C 107.008 -1.479 . . . . 0.25 107.008 177.728 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 58.5 p -61.78 -9.71 7.19 Favored 'General case' 0 C--N 1.303 -1.414 0 N-CA-C 109.279 -0.637 . . . . 0.22 109.279 -179.105 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 31.1 t30 -89.93 9.1 29.04 Favored 'General case' 0 N--CA 1.489 1.505 0 N-CA-C 108.271 -1.011 . . . . 1.13 108.271 179.044 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.8 t -127.37 144.88 35.94 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.592 0 N-CA-C 107.688 -1.227 . . . . 0.24 107.688 178.739 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 26.3 mm -99.92 122.76 52.18 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.085 0 O-C-N 120.99 -1.068 . . . . 0.15 109.594 -178.152 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.605 ' C ' HD12 ' A' ' 55' ' ' LEU . 50.5 m-85 -104.21 124.87 49.89 Favored 'General case' 0 N--CA 1.508 2.459 0 O-C-N 121.175 -0.953 . . . . 0.12 110.203 -179.813 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.605 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -111.31 140.34 45.96 Favored 'General case' 0 N--CA 1.507 2.392 0 O-C-N 121.071 -1.018 . . . . 0.22 109.903 178.804 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 52.2 tt0 -110.48 132.01 54.55 Favored 'General case' 0 N--CA 1.494 1.753 0 N-CA-C 107.019 -1.474 . . . . 1.13 107.019 177.84 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 64.7 t -125.63 136.08 61.96 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.103 0 O-C-N 121.464 -0.772 . . . . 0.15 110.847 -177.977 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.547 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.1 t0 -97.04 118.85 34.38 Favored 'General case' 0 N--CA 1.495 1.821 0 N-CA-C 108.396 -0.965 . . . . 1.05 108.396 179.332 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 14.6 m -68.03 -19.21 24.5 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.824 0 O-C-N 120.568 -1.333 . . . . 0.16 108.723 179.56 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.434 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 4.7 m-20 -93.68 -42.36 9.21 Favored 'General case' 0 N--CA 1.493 1.716 0 O-C-N 121.432 -0.793 . . . . 1.08 111.736 -179.232 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.426 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 52.8 m-20 -94.13 -15.77 24.38 Favored 'General case' 0 N--CA 1.504 2.254 0 O-C-N 120.574 -1.329 . . . . 1.07 108.489 179.636 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.547 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.83 38.42 4.2 Favored 'General case' 0 N--CA 1.493 1.676 0 N-CA-C 107.505 -1.295 . . . . 0.14 107.505 179.228 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.8 pt20 -59.95 -20.21 56.26 Favored 'General case' 0 C--N 1.3 -1.567 0 N-CA-C 109.376 -0.602 . . . . 1.47 109.376 -178.982 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.679 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.8 p30 -63.94 -39.12 93.43 Favored 'General case' 0 N--CA 1.487 1.419 0 O-C-N 121.153 -0.967 . . . . 1.05 109.156 179.446 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.679 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.8 t -73.39 -43.22 56.53 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.436 0 O-C-N 121.196 -0.94 . . . . 0.35 108.992 179.634 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.57 -40.05 80.72 Favored 'General case' 0 N--CA 1.489 1.51 0 O-C-N 121.528 -0.733 . . . . 0.26 110.935 -178.658 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.5 p -60.07 -37.6 80.36 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 120.797 -1.189 . . . . 0.24 108.556 -179.75 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 42.0 tt0 -65.93 -36.1 82.44 Favored 'General case' 0 C--N 1.303 -1.454 0 O-C-N 121.502 -0.749 . . . . 2.06 109.143 178.8 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -87.94 -2.18 58.45 Favored 'General case' 0 N--CA 1.494 1.73 0 O-C-N 121.293 -0.879 . . . . 0.23 111.217 -178.858 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 29.9 mp0 52.72 49.95 19.19 Favored 'General case' 0 N--CA 1.495 1.793 0 O-C-N 120.775 -1.203 . . . . 2.02 109.776 -179.82 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 41.3 t -64.94 131.99 30.75 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 C-N-CA 118.826 -1.15 . . . . 0.16 108.534 -179.413 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.0 mmtt -104.29 -12.78 16.43 Favored 'General case' 0 N--CA 1.489 1.477 0 O-C-N 121.694 -0.629 . . . . 1.6 109.73 -179.288 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.469 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.63 155.8 17.53 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 120.996 -1.065 . . . . 0.14 110.526 179.59 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.6 p -130.0 154.25 81.18 Favored Pre-proline 0 N--CA 1.501 2.112 0 N-CA-C 108.065 -1.087 . . . . 0.15 108.065 178.582 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 24.2 Cg_endo -76.0 143.92 78.16 Favored 'Cis proline' 0 N--CA 1.493 1.491 0 C-N-CA 123.987 -1.255 . . . . 0.16 112.852 -2.857 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.469 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 88.6 m -128.68 135.9 49.9 Favored 'General case' 0 N--CA 1.499 2.005 0 N-CA-C 108.493 -0.929 . . . . 0.13 108.493 178.828 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.818 ' CD2' HD21 ' A' ' 97' ' ' LEU . 87.5 m-85 -108.25 129.7 55.19 Favored 'General case' 0 N--CA 1.493 1.715 0 O-C-N 121.608 -0.683 . . . . 0.2 109.187 -179.075 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.2 mt-30 -122.3 136.17 54.86 Favored 'General case' 0 N--CA 1.495 1.798 0 N-CA-C 108.164 -1.05 . . . . 0.29 108.164 178.899 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 74.3 m-85 -104.57 134.83 47.09 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-O 121.417 0.627 . . . . 0.14 110.363 -179.025 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 85.5 m-85 -124.93 148.95 48.1 Favored 'General case' 0 N--CA 1.489 1.485 0 CA-C-O 121.621 0.724 . . . . 0.15 109.3 179.28 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 19.1 tptm -146.54 122.97 11.02 Favored 'General case' 0 C--N 1.301 -1.51 0 N-CA-C 107.049 -1.463 . . . . 1.68 107.049 179.679 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 74.4 mttt 58.05 27.27 14.63 Favored 'General case' 0 C--N 1.299 -1.62 0 N-CA-C 107.904 -1.147 . . . . 1.22 107.904 -178.403 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.454 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 80.49 11.04 84.58 Favored Glycine 0 N--CA 1.491 2.336 0 N-CA-C 110.515 -1.034 . . . . 0.23 110.515 -179.96 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.454 HE21 ' C ' ' A' ' 83' ' ' GLY . 6.4 mm-40 -112.63 134.52 54.11 Favored 'General case' 0 N--CA 1.501 2.12 0 O-C-N 121.413 -1.051 . . . . 2.07 109.919 -179.82 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 37.1 ttmt -79.31 123.91 27.9 Favored 'General case' 0 N--CA 1.49 1.537 0 N-CA-C 107.996 -1.113 . . . . 1.82 107.996 178.861 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 30.4 m -124.79 12.12 4.59 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.703 0 O-C-N 121.809 -0.557 . . . . 0.3 110.452 -179.197 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.41 152.44 11.07 Favored Glycine 0 N--CA 1.495 2.622 0 C-N-CA 118.685 -1.721 . . . . 0.17 111.496 179.818 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 71.6 tt0 -167.26 148.89 5.8 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.723 -0.869 . . . . 1.93 109.87 179.254 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.685 ' CG ' ' NZ ' ' A' ' 96' ' ' LYS . 21.9 p90 -164.02 162.59 23.25 Favored 'General case' 0 N--CA 1.494 1.733 0 C-N-CA 119.652 -0.819 . . . . 0.14 109.127 177.209 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.7 p -125.38 160.51 29.2 Favored 'General case' 0 N--CA 1.5 2.068 0 CA-C-O 121.609 0.719 . . . . 0.12 110.329 -179.014 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.486 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 118.61 140.06 6.27 Favored Glycine 0 N--CA 1.493 2.447 0 N-CA-C 109.47 -1.452 . . . . 0.12 109.47 179.684 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.29 66.95 3.99 Favored 'General case' 0 C--N 1.303 -1.415 0 O-C-N 121.372 -1.075 . . . . 0.18 111.042 -179.333 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -116.98 96.88 5.66 Favored 'General case' 0 N--CA 1.503 2.182 0 N-CA-C 106.919 -1.512 . . . . 0.88 106.919 177.861 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -69.39 -37.49 77.56 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.565 -0.709 . . . . 1.06 112.705 -177.783 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.6 mm-40 -63.08 -28.86 70.37 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 120.888 -1.133 . . . . 1.61 109.572 -179.768 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.685 ' NZ ' ' CG ' ' A' ' 89' ' ' PHE . 21.0 ttpp -63.93 -33.76 76.44 Favored 'General case' 0 C--N 1.297 -1.708 0 O-C-N 121.584 -0.698 . . . . 1.45 109.682 -179.032 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.818 HD21 ' CD2' ' A' ' 77' ' ' PHE . 34.2 mt -57.96 -38.91 76.89 Favored 'General case' 0 N--CA 1.488 1.443 0 N-CA-C 107.985 -1.117 . . . . 0.19 107.985 179.036 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -60.47 -42.13 95.61 Favored 'General case' 0 C--N 1.294 -1.811 0 CA-C-N 115.629 -0.714 . . . . 2.1 110.014 -178.673 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.08 -44.08 77.12 Favored 'General case' 0 N--CA 1.49 1.55 0 O-C-N 121.182 -0.948 . . . . 0.19 110.958 -179.239 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.5 m -66.34 -39.89 89.5 Favored 'General case' 0 N--CA 1.49 1.569 0 O-C-N 120.924 -1.11 . . . . 0.2 109.309 -179.158 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 64.5 mt -60.91 -49.65 83.8 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.843 0 N-CA-C 107.758 -1.201 . . . . 0.16 107.758 178.557 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.474 ' O ' HG12 ' A' ' 105' ' ' VAL . 20.0 t-20 -60.06 -35.42 75.1 Favored 'General case' 0 C--N 1.302 -1.469 0 CA-C-O 121.806 0.813 . . . . 0.95 109.024 178.934 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 33.3 tp10 -67.57 -40.0 84.88 Favored 'General case' 0 C--N 1.299 -1.622 0 O-C-N 121.523 -0.735 . . . . 2.21 109.986 -178.407 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.563 ' HB2' HD11 ' A' ' 22' ' ' LEU . 97.3 mt -100.16 1.08 41.71 Favored 'General case' 0 N--CA 1.504 2.235 0 O-C-N 121.224 -0.923 . . . . 0.25 111.605 -178.756 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.474 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.468 -1.395 . . . . 1.08 109.87 -179.237 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 80.9 Cg_endo . . . . . 0 N--CA 1.494 1.538 0 CA-C-O 121.074 0.364 . . . . 1.46 112.38 . . . . . . . . . 0 0 . 1 . 029 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -97.02 122.07 39.61 Favored 'General case' 0 N--CA 1.496 1.83 0 O-C-N 121.125 -0.984 . . . . 0.88 109.837 -179.552 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.458 HG22 ' H ' ' B' ' 63' ' ' LYS . 25.4 m -109.07 130.02 55.47 Favored 'General case' 0 N--CA 1.499 1.995 0 O-C-N 121.563 -0.711 . . . . 0.7 109.545 -179.783 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 67.1 mt -63.83 -29.76 70.92 Favored 'General case' 0 N--CA 1.495 1.778 0 O-C-N 121.088 -1.008 . . . . 0.61 109.567 179.821 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.458 ' H ' HG22 ' B' ' 61' ' ' THR . 30.3 mmtp -67.8 -15.87 63.84 Favored 'General case' 0 N--CA 1.493 1.719 0 O-C-N 121.418 -0.801 . . . . 1.31 109.609 -179.27 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.486 HD11 ' HA2' ' A' ' 91' ' ' GLY . 24.2 mm -129.96 140.49 48.83 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.534 0 O-C-N 121.765 -0.584 . . . . 0.15 110.065 -179.059 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 57.9 m -93.24 128.1 39.09 Favored 'General case' 0 N--CA 1.499 2.012 0 N-CA-C 107.309 -1.367 . . . . 0.19 107.309 177.431 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 68.7 m -80.28 137.13 36.56 Favored 'General case' 0 N--CA 1.498 1.964 0 O-C-N 121.043 -1.036 . . . . 0.2 111.211 -178.287 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.515 ' C ' ' H ' ' B' ' 69' ' ' VAL . 22.6 m95 -73.59 -10.31 59.58 Favored 'General case' 0 N--CA 1.496 1.842 0 O-C-N 121.091 -1.006 . . . . 0.21 109.309 179.001 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.434 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.9 m120 -54.31 -5.04 0.07 Allowed 'General case' 0 C--N 1.299 -1.6 0 O-C-N 121.596 -0.69 . . . . 0.49 109.355 179.666 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.515 ' H ' ' C ' ' B' ' 67' ' ' TRP . 3.3 t -40.57 138.54 0.4 Allowed 'Isoleucine or valine' 0 N--CA 1.499 2.002 0 O-C-N 121.515 -0.741 . . . . 1.04 109.867 -179.157 . . . . . . . . 2 2 . 1 . 029 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 29.2 m-20 -60.12 -37.31 79.65 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 121.356 -0.84 . . . . 1.36 108.959 -179.638 . . . . . . . . 1 1 . 1 . 029 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.284 0 CA-C-O 117.963 -1.465 . . . . 2.32 109.519 -179.821 . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 24.3 mmt . . . . . 0 N--CA 1.491 1.606 0 N-CA-C 108.874 -0.788 . . . . 2.88 108.874 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 94.7 t -98.94 134.89 36.14 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.052 0 O-C-N 121.245 -0.909 . . . . 0.45 109.469 -179.817 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 23.9 tptp -128.79 129.26 45.42 Favored 'General case' 0 N--CA 1.5 2.069 0 N-CA-C 108.174 -1.047 . . . . 1.67 108.174 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . 0.467 ' NE2' ' OE2' ' A' ' 6' ' ' GLU . 64.4 tt0 -97.77 122.87 41.38 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.717 -0.846 . . . . 0.31 108.717 179.945 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -101.3 114.49 40.67 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.445 0 N-CA-C 107.823 -1.177 . . . . 0.19 107.823 179.432 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.467 ' OE2' ' NE2' ' A' ' 4' ' ' GLN . 79.9 mm-40 -97.88 0.07 45.95 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 120.751 -1.218 . . . . 2.25 110.098 179.83 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 74.0 p -154.19 157.75 39.28 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.087 -1.008 . . . . 0.15 110.951 179.776 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 32.2 ttmt -63.14 -33.91 76.49 Favored 'General case' 0 N--CA 1.488 1.427 0 N-CA-C 108.313 -0.995 . . . . 1.65 108.313 178.487 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 56.1 m -56.37 -47.95 77.85 Favored 'General case' 0 C--N 1.304 -1.382 0 C-N-CA 119.626 -0.83 . . . . 0.23 109.066 -178.776 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.34 -29.58 68.35 Favored 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.199 -0.938 . . . . 0.17 109.28 178.517 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.566 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.5 t80 -59.66 -46.03 90.25 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 120.93 -1.106 . . . . 0.14 109.22 -179.315 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.6 mm-40 -65.52 -42.93 91.5 Favored 'General case' 0 C--N 1.3 -1.564 0 N-CA-C 109.067 -0.716 . . . . 1.31 109.067 -179.756 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -64.34 -36.09 82.99 Favored 'General case' 0 N--CA 1.491 1.625 0 O-C-N 121.719 -0.613 . . . . 1.77 109.819 179.57 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.92 -43.29 79.54 Favored 'General case' 0 C--N 1.302 -1.497 0 O-C-N 121.407 -0.808 . . . . 0.15 109.538 -179.77 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.566 HD11 ' CE2' ' A' ' 11' ' ' PHE . 86.9 mt -61.4 -40.0 92.78 Favored 'General case' 0 N--CA 1.486 1.353 0 O-C-N 121.176 -0.953 . . . . 0.17 108.698 179.99 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 26.9 t0 -69.28 -38.38 78.32 Favored 'General case' 0 N--CA 1.489 1.479 0 CA-C-O 121.658 0.742 . . . . 1.07 109.336 179.754 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.29 -35.48 76.07 Favored 'General case' 0 C--N 1.302 -1.467 0 CA-C-O 121.488 0.661 . . . . 0.18 109.909 -179.41 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.2 -22.19 64.53 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.252 -0.905 . . . . 0.17 110.462 -178.926 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 68.01 -140.99 37.07 Favored Glycine 0 N--CA 1.49 2.266 0 C-N-CA 119.006 -1.568 . . . . 0.2 109.71 179.741 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 71.8 m-20 -90.83 5.16 49.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.379 -1.071 . . . . 1.07 110.688 -179.11 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 53.0 mttm -74.06 152.29 39.99 Favored 'General case' 0 N--CA 1.497 1.903 0 O-C-N 120.878 -1.138 . . . . 1.5 109.676 -179.794 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.673 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.01 154.76 18.33 Favored 'General case' 0 N--CA 1.491 1.615 0 N-CA-C 108.197 -1.038 . . . . 0.47 108.197 -179.37 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.649 ' H ' HD23 ' A' ' 22' ' ' LEU . 58.2 t -142.56 113.41 2.84 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.603 0 O-C-N 120.987 -1.071 . . . . 0.17 109.358 -179.693 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 43.0 t -102.45 142.57 16.42 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.509 0 N-CA-C 108.087 -1.079 . . . . 0.14 108.087 179.73 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 35.0 t -125.51 123.16 64.18 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.07 0 O-C-N 121.453 -0.779 . . . . 0.13 109.553 -178.992 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.517 ' OD1' ' CE2' ' A' ' 77' ' ' PHE . 35.5 t70 -98.99 119.54 37.94 Favored 'General case' 0 N--CA 1.501 2.09 0 O-C-N 121.279 -0.888 . . . . 1.05 109.953 179.588 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.9 m-85 -96.63 25.82 4.89 Favored 'General case' 0 N--CA 1.502 2.151 0 O-C-N 121.237 -0.914 . . . . 0.73 109.577 179.433 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.418 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 53.2 m -59.99 145.52 45.9 Favored 'General case' 0 C--N 1.297 -1.681 0 O-C-N 121.146 -0.971 . . . . 0.3 110.23 -178.731 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.713 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.98 124.21 30.81 Favored 'General case' 0 C--N 1.303 -1.451 0 N-CA-C 107.919 -1.141 . . . . 0.22 107.919 179.189 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.1 t -68.24 -29.0 67.71 Favored 'General case' 0 C--N 1.297 -1.697 0 C-N-CA 119.29 -0.964 . . . . 0.3 108.585 -179.905 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.713 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 70.3 p-90 -76.42 -13.74 60.1 Favored 'General case' 0 N--CA 1.491 1.603 0 O-C-N 121.023 -1.048 . . . . 0.26 109.881 179.855 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 9.6 t -90.27 115.64 27.64 Favored 'General case' 0 N--CA 1.494 1.774 0 O-C-N 121.104 -0.997 . . . . 0.26 108.596 179.141 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.422 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.94 -53.99 40.58 Favored Glycine 0 N--CA 1.489 2.23 0 C-N-CA 120.41 -0.9 . . . . 0.23 111.33 -178.798 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.422 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 34.7 Cg_exo -50.35 -35.55 44.81 Favored 'Trans proline' 0 C--N 1.311 -1.418 0 CA-C-N 118.768 1.284 . . . . 0.31 112.096 -179.835 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.418 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -78.21 -47.16 18.63 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.401 -0.812 . . . . 0.24 110.008 -179.545 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.6 tttt -59.93 -32.21 70.57 Favored 'General case' 0 N--CA 1.493 1.706 0 O-C-N 121.176 -0.953 . . . . 1.59 109.348 179.6 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.502 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.83 -29.19 68.09 Favored 'General case' 0 N--CA 1.492 1.651 0 O-C-N 121.551 -0.718 . . . . 2.1 110.243 -179.746 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.559 HD11 ' HB1' ' A' ' 92' ' ' ALA . 21.4 mt -80.99 -4.41 7.51 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.027 0 O-C-N 121.655 -0.653 . . . . 0.49 111.069 -179.036 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.543 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -60.01 -31.76 10.16 Favored Pre-proline 0 N--CA 1.493 1.716 0 O-C-N 120.138 -1.601 . . . . 0.8 113.211 -177.409 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.543 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 38.4 Cg_exo -59.76 -36.38 91.57 Favored 'Trans proline' 0 N--CA 1.49 1.269 0 CA-C-N 121.573 1.597 . . . . 0.28 112.162 -178.421 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 61.5 m-85 -72.37 -51.81 18.86 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 118.953 -1.099 . . . . 0.37 108.498 179.588 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 84.4 t80 -59.81 -47.23 86.53 Favored 'General case' 0 C--N 1.302 -1.467 0 O-C-N 121.391 -0.818 . . . . 0.16 109.056 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 50.5 t60 -68.36 -43.03 78.33 Favored 'General case' 0 N--CA 1.494 1.737 0 O-C-N 121.557 -0.715 . . . . 0.32 110.877 179.667 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.423 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 69.8 m -64.03 -38.23 90.3 Favored 'General case' 0 N--CA 1.496 1.852 0 O-C-N 120.954 -1.091 . . . . 0.22 110.679 -179.306 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.2 mt -61.92 -23.92 66.64 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 121.396 -0.815 . . . . 0.22 110.735 -178.376 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 68.2 m -54.26 -38.05 65.37 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.793 -1.192 . . . . 0.16 108.397 -179.426 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -83.63 -17.87 40.07 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.283 -0.886 . . . . 2.16 109.256 178.948 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 87.6 tttt -76.34 -36.82 58.04 Favored 'General case' 0 N--CA 1.492 1.627 0 O-C-N 120.749 -1.219 . . . . 1.78 108.004 179.989 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 74.9 m-85 -123.53 65.69 1.01 Allowed 'General case' 0 N--CA 1.492 1.667 0 N-CA-C 106.58 -1.637 . . . . 0.25 106.58 178.108 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 69.5 p -62.41 -9.78 9.42 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 108.53 -0.915 . . . . 0.22 108.53 -179.396 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.3 t30 -89.37 8.9 28.31 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 107.787 -1.19 . . . . 1.13 107.787 178.727 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.428 HG13 ' HB3' ' A' ' 22' ' ' LEU . 58.4 t -127.87 145.16 35.57 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.635 0 N-CA-C 108.161 -1.052 . . . . 0.24 108.161 179.152 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 31.2 mm -100.01 122.47 51.94 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.119 0 O-C-N 121.065 -1.022 . . . . 0.15 109.249 -179.12 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.602 ' C ' HD12 ' A' ' 55' ' ' LEU . 33.4 m-85 -103.68 129.31 50.99 Favored 'General case' 0 N--CA 1.509 2.482 0 O-C-N 121.169 -0.957 . . . . 0.12 109.521 179.598 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.602 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -111.94 142.37 44.43 Favored 'General case' 0 N--CA 1.506 2.351 0 O-C-N 121.126 -0.984 . . . . 0.22 109.985 179.168 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -110.95 130.22 55.65 Favored 'General case' 0 N--CA 1.491 1.597 0 N-CA-C 107.016 -1.476 . . . . 1.13 107.016 177.732 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.7 t -128.86 134.38 64.43 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.477 -0.765 . . . . 0.15 110.748 -177.888 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.573 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.9 t0 -95.19 119.8 34.32 Favored 'General case' 0 N--CA 1.493 1.717 0 O-C-N 121.485 -0.759 . . . . 1.05 109.232 179.614 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 34.5 m -67.91 -16.68 21.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.564 0 O-C-N 120.575 -1.328 . . . . 0.16 108.306 179.139 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.545 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 11.1 m-20 -94.1 -44.12 8.17 Favored 'General case' 0 N--CA 1.498 1.944 0 O-C-N 121.439 -0.788 . . . . 1.08 111.696 -179.744 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . 0.456 ' H ' ' CG ' ' A' ' 58' ' ' ASP . 68.7 m-20 -95.81 -14.36 23.33 Favored 'General case' 0 N--CA 1.501 2.097 0 O-C-N 120.728 -1.232 . . . . 1.07 108.654 -179.87 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.573 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.03 38.23 4.24 Favored 'General case' 0 N--CA 1.491 1.618 0 N-CA-C 107.364 -1.347 . . . . 0.14 107.364 179.27 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 26.9 pt20 -59.94 -23.17 63.34 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.758 -0.589 . . . . 1.47 110.065 -178.597 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.579 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.7 p30 -65.94 -37.58 86.4 Favored 'General case' 0 C--N 1.299 -1.598 0 O-C-N 121.042 -1.036 . . . . 1.05 108.9 179.171 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.579 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.8 t -71.34 -44.1 72.81 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.487 0 O-C-N 121.263 -0.898 . . . . 0.35 109.548 179.648 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -70.85 -42.09 70.57 Favored 'General case' 0 N--CA 1.488 1.472 0 O-C-N 121.442 -0.786 . . . . 0.26 111.14 -178.449 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 95.0 p -60.06 -32.88 71.35 Favored 'General case' 0 N--CA 1.49 1.555 0 O-C-N 121.084 -1.01 . . . . 0.24 109.157 -179.243 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 71.9 tt0 -60.66 -38.33 84.53 Favored 'General case' 0 C--N 1.302 -1.457 0 N-CA-C 108.958 -0.756 . . . . 2.06 108.958 179.176 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.432 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -92.02 1.4 57.22 Favored 'General case' 0 N--CA 1.491 1.587 0 O-C-N 121.438 -0.789 . . . . 0.23 110.809 -179.251 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.9 mm-40 54.89 50.51 15.45 Favored 'General case' 0 N--CA 1.497 1.909 0 O-C-N 121.025 -1.047 . . . . 2.02 109.306 -179.328 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 24.4 t -64.48 133.1 30.29 Favored 'Isoleucine or valine' 0 C--N 1.295 -1.797 0 C-N-CA 118.324 -1.35 . . . . 0.16 107.959 -179.283 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.6 mmtt -105.79 -10.99 16.43 Favored 'General case' 0 N--CA 1.49 1.574 0 O-C-N 121.6 -0.688 . . . . 1.6 109.917 -179.121 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.49 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -161.27 156.04 23.51 Favored 'General case' 0 N--CA 1.494 1.763 0 O-C-N 120.848 -1.157 . . . . 0.14 111.214 -179.654 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.7 p -129.81 154.36 81.04 Favored Pre-proline 0 N--CA 1.503 2.204 0 N-CA-C 108.263 -1.014 . . . . 0.15 108.263 179.059 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -76.42 141.63 70.69 Favored 'Cis proline' 0 N--CA 1.495 1.588 0 C-N-CA 123.929 -1.28 . . . . 0.16 112.799 -2.505 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.486 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.5 m -127.47 132.54 49.99 Favored 'General case' 0 N--CA 1.499 1.981 0 CA-C-O 121.648 0.737 . . . . 0.13 109.39 178.832 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.814 ' CD2' HD21 ' A' ' 97' ' ' LEU . 88.7 m-85 -108.52 131.75 54.51 Favored 'General case' 0 N--CA 1.492 1.645 0 N-CA-C 109.011 -0.737 . . . . 0.2 109.011 179.979 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.432 HE22 ' CB ' ' A' ' 69' ' ' ALA . 73.9 mt-30 -120.72 143.04 48.98 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 108.395 -0.965 . . . . 0.29 108.395 179.121 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.417 ' CE1' HG21 ' A' ' 100' ' ' THR . 75.0 m-85 -109.0 133.49 52.91 Favored 'General case' 0 C--N 1.297 -1.709 0 CA-C-O 121.708 0.766 . . . . 0.14 110.449 -179.249 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 72.3 m-85 -128.83 143.6 50.95 Favored 'General case' 0 N--CA 1.486 1.334 0 N-CA-C 109.383 -0.599 . . . . 0.15 109.383 179.557 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 2.5 ttmp? -146.37 125.93 13.3 Favored 'General case' 0 N--CA 1.489 1.497 0 N-CA-C 106.71 -1.589 . . . . 1.68 106.71 178.807 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 86.7 mttt 58.29 29.42 18.05 Favored 'General case' 0 N--CA 1.494 1.772 0 N-CA-C 108.559 -0.904 . . . . 1.22 108.559 -178.466 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.575 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 77.7 11.73 85.16 Favored Glycine 0 N--CA 1.492 2.416 0 N-CA-C 109.744 -1.342 . . . . 0.23 109.744 -179.909 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.575 HE21 ' C ' ' A' ' 83' ' ' GLY . 4.5 mm-40 -111.43 132.39 54.5 Favored 'General case' 0 N--CA 1.5 2.069 0 O-C-N 121.509 -0.994 . . . . 2.07 109.989 -179.053 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 87.7 tttt -78.41 121.01 23.95 Favored 'General case' 0 N--CA 1.496 1.863 0 N-CA-C 108.048 -1.093 . . . . 1.82 108.048 178.538 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 27.5 m -123.99 11.47 4.96 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.569 0 O-C-N 121.777 -0.577 . . . . 0.3 110.627 -178.938 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -174.2 151.42 12.87 Favored Glycine 0 N--CA 1.497 2.721 0 C-N-CA 118.175 -1.964 . . . . 0.17 112.137 179.988 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' O ' ' A' ' 77' ' ' PHE . 3.8 tp10 -163.75 140.22 6.8 Favored 'General case' 0 N--CA 1.489 1.494 0 O-C-N 121.923 -0.751 . . . . 1.93 109.218 179.918 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.466 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 3.9 p90 -163.87 156.86 18.1 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.568 -0.707 . . . . 0.14 109.246 178.356 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.2 p -126.71 160.25 31.34 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.596 -0.69 . . . . 0.12 110.064 -179.337 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.499 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 124.85 139.43 5.26 Favored Glycine 0 N--CA 1.494 2.507 0 N-CA-C 109.347 -1.501 . . . . 0.12 109.347 179.465 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.559 ' HB1' HD11 ' A' ' 38' ' ' ILE . . . -76.54 63.45 2.06 Favored 'General case' 0 C--N 1.304 -1.391 0 O-C-N 121.353 -1.086 . . . . 0.18 109.68 -179.839 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.489 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -118.76 102.25 8.68 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.732 -0.84 . . . . 0.88 108.732 178.557 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.426 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.7 -36.25 75.77 Favored 'General case' 0 C--N 1.296 -1.76 0 O-C-N 121.338 -0.851 . . . . 1.06 111.613 -179.846 . . . . . . . . 3 3 . 1 . 030 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.5 mm-40 -61.2 -29.41 69.8 Favored 'General case' 0 N--CA 1.487 1.4 0 O-C-N 120.844 -1.16 . . . . 1.61 109.472 -179.822 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.489 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 50.5 tttp -60.98 -36.11 78.57 Favored 'General case' 0 N--CA 1.489 1.496 0 O-C-N 121.591 -0.693 . . . . 1.45 109.205 -179.242 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.814 HD21 ' CD2' ' A' ' 77' ' ' PHE . 45.1 mt -59.05 -39.93 83.56 Favored 'General case' 0 N--CA 1.489 1.502 0 CA-C-O 122.1 0.952 . . . . 0.19 108.924 179.882 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.5 tt0 -63.02 -41.58 99.58 Favored 'General case' 0 C--N 1.293 -1.85 0 C-N-CA 120.074 -0.65 . . . . 2.1 111.077 -178.115 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.03 -43.25 79.19 Favored 'General case' 0 C--N 1.295 -1.772 0 O-C-N 121.059 -1.026 . . . . 0.19 111.526 -178.293 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . 0.417 HG21 ' CE1' ' A' ' 79' ' ' PHE . 21.7 m -66.75 -39.94 88.09 Favored 'General case' 0 N--CA 1.491 1.592 0 O-C-N 120.858 -1.151 . . . . 0.2 109.892 -178.332 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 59.6 mt -60.93 -48.97 86.6 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.767 0 N-CA-C 108.237 -1.023 . . . . 0.16 108.237 179.565 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.454 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.7 t-20 -60.16 -35.63 75.74 Favored 'General case' 0 C--N 1.301 -1.527 0 CA-C-O 121.998 0.904 . . . . 0.95 108.675 178.616 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 4.6 tm-20 -67.54 -39.79 85.02 Favored 'General case' 0 C--N 1.299 -1.624 0 CA-C-N 115.994 -0.548 . . . . 2.21 109.956 -177.976 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.673 ' HB2' HD11 ' A' ' 22' ' ' LEU . 89.5 mt -99.79 -1.64 37.13 Favored 'General case' 0 N--CA 1.499 2.016 0 O-C-N 121.258 -0.901 . . . . 0.25 111.189 -179.173 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.454 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.496 1.84 0 O-C-N 120.401 -1.437 . . . . 1.08 109.12 -179.274 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 75.2 Cg_exo . . . . . 0 N--CA 1.494 1.543 0 CA-C-O 121.141 0.392 . . . . 1.46 112.24 . . . . . . . . . 0 0 . 1 . 030 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.74 124.25 37.62 Favored 'General case' 0 N--CA 1.497 1.898 0 O-C-N 121.142 -0.974 . . . . 0.88 108.808 179.456 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.468 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.5 m -107.2 130.12 54.77 Favored 'General case' 0 N--CA 1.497 1.901 0 O-C-N 121.22 -0.925 . . . . 0.7 109.624 -179.261 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 71.5 mt -68.07 -29.13 68.02 Favored 'General case' 0 N--CA 1.489 1.512 0 O-C-N 121.358 -0.838 . . . . 0.61 109.33 179.256 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.468 ' H ' HG22 ' B' ' 61' ' ' THR . 42.5 mmtm -62.18 -19.97 63.66 Favored 'General case' 0 N--CA 1.495 1.818 0 O-C-N 121.451 -0.78 . . . . 1.31 110.373 -179.055 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.499 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.5 mm -132.78 142.77 41.51 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.476 0 O-C-N 121.523 -0.735 . . . . 0.15 109.149 -179.814 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 3.9 m -103.88 125.86 50.6 Favored 'General case' 0 N--CA 1.501 2.097 0 N-CA-C 106.803 -1.554 . . . . 0.19 106.803 177.431 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.2 m -79.33 143.85 34.77 Favored 'General case' 0 N--CA 1.498 1.958 0 O-C-N 120.849 -1.157 . . . . 0.2 111.227 -178.1 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.49 ' HE1' ' CA ' ' A' ' 73' ' ' ALA . 26.3 m95 -75.91 -10.56 59.52 Favored 'General case' 0 N--CA 1.492 1.661 0 O-C-N 121.229 -0.919 . . . . 0.21 108.718 179.158 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.51 ' N ' HD22 ' B' ' 68' ' ' ASN . 1.5 m120 -51.57 -12.12 0.16 Allowed 'General case' 0 N--CA 1.489 1.481 0 N-CA-C 108.589 -0.893 . . . . 0.49 108.589 -179.914 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.464 ' N ' ' C ' ' B' ' 67' ' ' TRP . 15.5 m -65.26 142.67 16.59 Favored 'Isoleucine or valine' 0 C--N 1.305 -1.339 0 O-C-N 121.357 -0.839 . . . . 1.04 108.775 179.067 . . . . . . . . 2 2 . 1 . 030 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 72.4 m-20 -59.92 -40.0 87.36 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.253 -0.905 . . . . 1.36 109.331 -179.464 . . . . . . . . 1 1 . 1 . 030 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.291 0 N-CA-C 109.378 -1.489 . . . . 2.32 109.378 -179.812 . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.7 mmt . . . . . 0 N--CA 1.49 1.541 0 CA-C-O 121.155 0.502 . . . . 2.88 109.781 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 75.8 t -98.63 140.53 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.149 0 O-C-N 121.433 -0.792 . . . . 0.45 109.534 -179.932 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 27.4 tptp -130.43 130.18 43.96 Favored 'General case' 0 N--CA 1.498 1.942 0 O-C-N 121.417 -0.802 . . . . 1.67 109.065 -179.522 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 62.7 tt0 -97.03 123.2 40.69 Favored 'General case' 0 N--CA 1.494 1.744 0 O-C-N 121.512 -0.742 . . . . 0.31 109.176 179.352 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 30.5 mm -100.34 115.53 41.85 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.713 0 O-C-N 121.204 -0.935 . . . . 0.19 108.674 178.712 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 55.1 mm-40 -98.15 -0.42 44.33 Favored 'General case' 0 N--CA 1.491 1.618 0 O-C-N 121.374 -0.829 . . . . 2.25 109.344 179.518 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.6 p -154.57 155.6 35.07 Favored 'General case' 0 N--CA 1.501 2.107 0 O-C-N 120.672 -1.267 . . . . 0.15 111.944 -179.634 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 28.7 ttmt -62.23 -33.16 74.06 Favored 'General case' 0 N--CA 1.489 1.511 0 N-CA-C 108.138 -1.06 . . . . 1.65 108.138 178.389 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . 0.442 ' O ' ' OE2' ' A' ' 13' ' ' GLU . 80.3 m -58.12 -47.83 82.07 Favored 'General case' 0 C--N 1.305 -1.36 0 O-C-N 121.406 -0.809 . . . . 0.23 109.329 -179.473 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.74 -30.71 68.38 Favored 'General case' 0 C--N 1.297 -1.7 0 O-C-N 121.154 -0.966 . . . . 0.17 108.623 178.843 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.492 ' CE2' HD11 ' A' ' 15' ' ' LEU . 46.1 t80 -59.57 -43.77 93.5 Favored 'General case' 0 N--CA 1.492 1.642 0 O-C-N 121.146 -0.971 . . . . 0.14 108.849 -179.372 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 27.2 mm100 -64.24 -43.31 95.32 Favored 'General case' 0 C--N 1.294 -1.847 0 N-CA-C 109.123 -0.695 . . . . 1.31 109.123 179.938 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . 0.557 ' N ' ' OE1' ' A' ' 13' ' ' GLU . 0.4 OUTLIER -64.4 -39.34 93.66 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.505 -0.747 . . . . 1.77 110.353 179.957 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -65.85 -41.22 91.97 Favored 'General case' 0 C--N 1.297 -1.714 0 O-C-N 121.426 -0.796 . . . . 0.15 108.95 -179.301 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.492 HD11 ' CE2' ' A' ' 11' ' ' PHE . 51.6 mt -62.15 -39.99 94.46 Favored 'General case' 0 C--N 1.305 -1.338 0 O-C-N 120.911 -1.118 . . . . 0.17 108.809 179.414 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 23.1 t70 -69.86 -34.8 74.09 Favored 'General case' 0 N--CA 1.491 1.578 0 O-C-N 121.424 -0.797 . . . . 1.07 109.95 -179.664 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -69.45 -36.77 76.93 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.326 -0.859 . . . . 0.18 110.212 -179.606 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.41 -36.54 80.59 Favored 'General case' 0 C--N 1.3 -1.57 0 O-C-N 121.229 -0.919 . . . . 0.17 109.373 -179.979 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.32 -124.58 22.59 Favored Glycine 0 N--CA 1.486 1.971 0 N-CA-C 109.656 -1.377 . . . . 0.2 109.656 -179.415 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 68.7 m-20 -89.98 2.07 55.56 Favored 'General case' 0 N--CA 1.494 1.748 0 O-C-N 121.11 -1.229 . . . . 1.07 110.592 -178.797 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 69.6 mttt -74.61 150.22 39.74 Favored 'General case' 0 N--CA 1.496 1.837 0 O-C-N 120.829 -1.169 . . . . 1.5 109.697 -179.933 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.685 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -61.34 156.24 19.41 Favored 'General case' 0 N--CA 1.493 1.717 0 N-CA-C 107.075 -1.454 . . . . 0.47 107.075 179.741 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.599 ' H ' HD23 ' A' ' 22' ' ' LEU . 78.7 t -143.46 112.69 2.03 Favored 'Isoleucine or valine' 0 C--N 1.303 -1.437 0 O-C-N 120.991 -1.068 . . . . 0.17 108.94 -179.532 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -103.0 138.85 25.67 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.731 0 N-CA-C 108.498 -0.927 . . . . 0.14 108.498 179.776 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 42.1 t -122.08 119.66 59.15 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.939 0 O-C-N 121.488 -0.757 . . . . 0.13 109.16 -179.441 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.571 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 26.5 t70 -98.99 109.09 21.9 Favored 'General case' 0 N--CA 1.493 1.687 0 O-C-N 121.525 -0.735 . . . . 1.05 110.344 179.836 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 75.7 m-85 -89.95 102.81 15.52 Favored 'General case' 0 N--CA 1.49 1.544 0 N-CA-C 106.754 -1.573 . . . . 0.73 106.754 177.548 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 60.0 m -129.01 146.56 50.95 Favored 'General case' 0 N--CA 1.495 1.791 0 N-CA-C 108.794 -0.817 . . . . 0.3 108.794 -179.743 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.552 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -85.73 122.67 30.15 Favored 'General case' 0 C--N 1.301 -1.522 0 N-CA-C 107.777 -1.194 . . . . 0.22 107.777 179.104 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.0 t -65.72 -34.09 77.38 Favored 'General case' 0 C--N 1.296 -1.759 0 C-N-CA 118.92 -1.112 . . . . 0.3 108.724 -179.758 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.552 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 46.2 p-90 -70.73 -23.56 62.46 Favored 'General case' 0 N--CA 1.5 2.058 0 O-C-N 121.366 -0.833 . . . . 0.26 110.634 179.797 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.4 t -84.2 112.97 20.75 Favored 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 107.621 -1.251 . . . . 0.26 107.621 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.494 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -59.61 -49.16 81.53 Favored Glycine 0 N--CA 1.487 2.057 0 C-N-CA 120.415 -0.898 . . . . 0.23 111.086 -178.298 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.494 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 36.6 Cg_exo -53.46 -35.38 75.77 Favored 'Trans proline' 0 N--CA 1.495 1.56 0 CA-C-N 118.616 1.208 . . . . 0.31 112.704 179.913 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -75.97 -55.77 5.29 Favored 'General case' 0 N--CA 1.492 1.657 0 O-C-N 121.228 -0.92 . . . . 0.24 109.928 -179.682 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 55.5 tttm -59.82 -37.43 79.17 Favored 'General case' 0 C--N 1.299 -1.587 0 O-C-N 121.144 -0.973 . . . . 1.59 109.421 -179.837 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.401 ' O ' ' CD ' ' A' ' 40' ' ' PRO . 37.6 ttm -59.69 -28.95 67.75 Favored 'General case' 0 N--CA 1.491 1.576 0 O-C-N 121.109 -0.995 . . . . 2.1 109.994 -179.618 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.586 HG22 ' O ' ' A' ' 38' ' ' ILE . 65.2 mt -80.05 -4.5 7.3 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.642 0 O-C-N 121.725 -0.609 . . . . 0.49 110.926 -179.499 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.523 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 14.2 ptmt -65.39 -26.11 1.63 Allowed Pre-proline 0 N--CA 1.491 1.592 0 O-C-N 120.382 -1.449 . . . . 0.8 114.604 -177.548 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.523 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.6 Cg_exo -57.56 -37.99 95.25 Favored 'Trans proline' 0 N--CA 1.494 1.534 0 CA-C-N 122.536 1.941 . . . . 0.28 113.148 -176.648 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 40.8 m-85 -69.88 -43.31 72.07 Favored 'General case' 0 N--CA 1.489 1.484 0 C-N-CA 118.049 -1.46 . . . . 0.37 108.478 -179.805 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 91.6 t80 -63.65 -50.57 68.76 Favored 'General case' 0 C--N 1.298 -1.655 0 CA-C-O 122.001 0.905 . . . . 0.16 109.788 179.208 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 42.0 t60 -68.01 -44.03 77.49 Favored 'General case' 0 C--N 1.293 -1.86 0 CA-C-O 121.237 0.541 . . . . 0.32 109.691 179.701 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.453 ' OG ' ' O ' ' A' ' 40' ' ' PRO . 69.1 m -60.71 -37.15 80.74 Favored 'General case' 0 N--CA 1.492 1.666 0 O-C-N 120.983 -1.073 . . . . 0.22 110.498 179.975 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.7 mt -63.48 -22.3 66.81 Favored 'General case' 0 N--CA 1.498 1.926 0 O-C-N 120.705 -1.247 . . . . 0.22 110.833 -178.527 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.1 m -53.71 -37.4 63.26 Favored 'General case' 0 C--N 1.3 -1.559 0 O-C-N 120.967 -1.083 . . . . 0.16 108.279 -179.252 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.511 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 54.7 mp0 -85.65 -17.73 35.24 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.066 -1.021 . . . . 2.16 109.47 179.708 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.1 tttt -77.28 -35.71 54.87 Favored 'General case' 0 N--CA 1.498 1.95 0 N-CA-C 107.754 -1.202 . . . . 1.78 107.754 179.228 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.2 m-85 -124.94 66.57 1.11 Allowed 'General case' 0 N--CA 1.494 1.727 0 N-CA-C 106.906 -1.516 . . . . 0.25 106.906 178.025 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 77.4 p -64.2 -7.96 10.88 Favored 'General case' 0 C--N 1.305 -1.362 0 N-CA-C 108.829 -0.804 . . . . 0.22 108.829 -179.129 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.3 t30 -91.09 10.16 27.97 Favored 'General case' 0 N--CA 1.487 1.425 0 N-CA-C 108.458 -0.941 . . . . 1.13 108.458 179.139 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.401 HG13 ' HB3' ' A' ' 22' ' ' LEU . 44.7 t -128.03 149.92 33.35 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.77 0 N-CA-C 107.996 -1.113 . . . . 0.24 107.996 179.392 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.0 mm -100.72 122.19 52.42 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.117 0 O-C-N 120.791 -1.193 . . . . 0.15 109.044 -178.839 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.623 ' C ' HD12 ' A' ' 55' ' ' LEU . 63.6 m-85 -106.95 128.88 54.72 Favored 'General case' 0 N--CA 1.509 2.507 0 O-C-N 121.071 -1.018 . . . . 0.12 109.33 179.753 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.623 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -114.95 142.25 46.87 Favored 'General case' 0 N--CA 1.51 2.57 0 O-C-N 120.924 -1.11 . . . . 0.22 109.5 179.183 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 48.0 tt0 -111.77 130.13 55.9 Favored 'General case' 0 N--CA 1.5 2.043 0 N-CA-C 106.753 -1.573 . . . . 1.13 106.753 177.703 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 47.3 t -126.39 137.72 56.9 Favored 'Isoleucine or valine' 0 N--CA 1.506 2.356 0 O-C-N 121.267 -0.896 . . . . 0.15 111.741 -177.571 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.517 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 56.2 t0 -99.1 119.56 38.04 Favored 'General case' 0 N--CA 1.497 1.893 0 N-CA-C 108.702 -0.851 . . . . 1.05 108.702 179.14 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 31.9 m -70.33 -16.95 20.4 Favored 'Isoleucine or valine' 0 C--N 1.297 -1.689 0 O-C-N 120.946 -1.096 . . . . 0.16 108.918 179.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.486 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 4.3 m-20 -95.2 -39.6 10.01 Favored 'General case' 0 N--CA 1.492 1.668 0 O-C-N 121.194 -0.941 . . . . 1.08 111.547 -179.376 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 55.9 m-20 -96.24 -17.96 20.38 Favored 'General case' 0 N--CA 1.503 2.191 0 O-C-N 120.832 -1.167 . . . . 1.07 108.216 179.453 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.517 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -124.92 41.2 3.57 Favored 'General case' 0 N--CA 1.491 1.611 0 N-CA-C 107.477 -1.305 . . . . 0.14 107.477 179.031 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 18.4 pt20 -60.43 -25.67 66.15 Favored 'General case' 0 N--CA 1.49 1.525 0 O-C-N 121.831 -0.543 . . . . 1.47 109.697 -178.747 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.614 ' OD1' HG23 ' A' ' 65' ' ' VAL . 2.1 p30 -62.97 -38.68 92.08 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 120.912 -1.118 . . . . 1.05 109.162 179.241 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.614 HG23 ' OD1' ' A' ' 64' ' ' ASP . 11.7 t -70.51 -44.27 77.17 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 121.193 -0.942 . . . . 0.35 109.868 -179.843 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.01 -37.31 69.81 Favored 'General case' 0 N--CA 1.49 1.556 0 O-C-N 121.364 -0.835 . . . . 0.26 111.255 -178.879 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 92.0 p -60.27 -33.96 73.06 Favored 'General case' 0 N--CA 1.49 1.562 0 O-C-N 120.793 -1.192 . . . . 0.24 109.381 -178.865 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.1 tm-20 -63.67 -36.57 84.28 Favored 'General case' 0 C--N 1.301 -1.523 0 O-C-N 121.576 -0.702 . . . . 2.06 109.801 179.615 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.88 -1.95 58.35 Favored 'General case' 0 N--CA 1.496 1.831 0 O-C-N 121.426 -0.797 . . . . 0.23 111.302 -178.781 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 77.9 mm-40 56.94 48.8 15.14 Favored 'General case' 0 N--CA 1.498 1.933 0 O-C-N 121.033 -1.042 . . . . 2.02 109.578 -179.288 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 28.0 t -64.39 129.78 28.7 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.461 0 O-C-N 120.809 -1.182 . . . . 0.16 108.056 -179.828 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.3 mmtp -103.04 -11.77 17.9 Favored 'General case' 0 N--CA 1.487 1.416 0 O-C-N 121.718 -0.613 . . . . 1.6 109.982 -179.387 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.508 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -162.68 154.24 17.97 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 120.801 -1.187 . . . . 0.14 110.377 179.767 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.408 HG23 ' NE1' ' B' ' 67' ' ' TRP . 33.0 p -130.12 155.55 80.58 Favored Pre-proline 0 N--CA 1.506 2.344 0 O-C-N 121.146 -0.971 . . . . 0.15 108.767 179.039 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.2 Cg_endo -73.56 144.67 81.74 Favored 'Cis proline' 0 N--CA 1.493 1.495 0 C-N-CA 123.934 -1.277 . . . . 0.16 112.999 -2.586 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.508 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.4 m -130.1 134.7 47.53 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 108.033 -1.099 . . . . 0.13 108.033 178.69 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.571 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 87.4 m-85 -109.88 131.25 55.23 Favored 'General case' 0 N--CA 1.497 1.893 0 O-C-N 121.426 -0.796 . . . . 0.2 109.129 -179.14 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 76.5 mt-30 -124.3 140.43 52.97 Favored 'General case' 0 N--CA 1.493 1.708 0 N-CA-C 108.289 -1.004 . . . . 0.29 108.289 179.766 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 66.1 m-85 -108.29 135.85 48.91 Favored 'General case' 0 C--N 1.299 -1.593 0 CA-C-O 121.436 0.636 . . . . 0.14 110.232 -179.32 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.8 m-85 -127.02 146.53 50.32 Favored 'General case' 0 C--N 1.299 -1.589 0 N-CA-C 108.669 -0.863 . . . . 0.15 108.669 178.557 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -143.4 121.64 12.25 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 107.759 -1.2 . . . . 1.68 107.759 -179.843 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 91.3 mttt 60.03 27.35 16.76 Favored 'General case' 0 N--CA 1.497 1.905 0 O-C-N 121.596 -0.69 . . . . 1.22 109.857 -179.427 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 83.73 15.58 70.24 Favored Glycine 0 N--CA 1.495 2.623 0 O-C-N 120.899 -1.126 . . . . 0.23 110.994 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -127.05 142.2 51.59 Favored 'General case' 0 N--CA 1.498 1.938 0 O-C-N 121.049 -1.265 . . . . 2.07 110.172 -179.781 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . 0.457 ' NZ ' ' OE1' ' A' ' 88' ' ' GLU . 33.1 ttpt -79.6 126.75 31.31 Favored 'General case' 0 N--CA 1.493 1.71 0 O-C-N 121.243 -0.911 . . . . 1.82 108.977 179.762 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 31.5 m -119.98 11.55 6.55 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.876 0 O-C-N 121.647 -0.658 . . . . 0.3 110.683 -179.21 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 165.03 157.31 9.61 Favored Glycine 0 N--CA 1.492 2.403 0 C-N-CA 118.501 -1.809 . . . . 0.17 111.492 179.591 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.457 ' OE1' ' NZ ' ' A' ' 85' ' ' LYS . 12.3 pt-20 -165.97 158.11 14.45 Favored 'General case' 0 N--CA 1.491 1.583 0 O-C-N 121.775 -0.838 . . . . 1.93 109.794 179.231 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 35.2 p90 -164.09 163.26 23.21 Favored 'General case' 0 N--CA 1.499 2.023 0 C-N-CA 119.27 -0.972 . . . . 0.14 109.976 176.844 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.26 160.73 29.51 Favored 'General case' 0 N--CA 1.505 2.308 0 CA-C-O 121.633 0.73 . . . . 0.12 110.175 -179.357 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.527 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 116.58 141.77 7.2 Favored Glycine 0 N--CA 1.492 2.427 0 N-CA-C 108.776 -1.729 . . . . 0.12 108.776 -179.873 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -78.1 68.5 4.15 Favored 'General case' 0 C--N 1.3 -1.578 0 O-C-N 121.315 -1.109 . . . . 0.18 111.489 -178.84 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.447 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.7 t-20 -117.84 100.4 7.56 Favored 'General case' 0 N--CA 1.503 2.206 0 N-CA-C 108.289 -1.004 . . . . 0.88 108.289 177.871 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.469 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -69.03 -33.27 73.35 Favored 'General case' 0 C--N 1.3 -1.575 0 O-C-N 121.173 -0.954 . . . . 1.06 111.619 -179.263 . . . . . . . . 3 3 . 1 . 031 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -65.86 -29.06 69.45 Favored 'General case' 0 C--N 1.3 -1.548 0 O-C-N 120.621 -1.3 . . . . 1.61 110.063 -179.225 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.447 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 43.3 tttp -60.93 -34.31 74.51 Favored 'General case' 0 N--CA 1.489 1.506 0 N-CA-C 108.509 -0.923 . . . . 1.45 108.509 -179.086 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.417 HD21 ' CD1' ' A' ' 77' ' ' PHE . 43.3 mt -60.13 -40.05 88.43 Favored 'General case' 0 C--N 1.3 -1.547 0 CA-C-O 121.714 0.768 . . . . 0.19 109.008 179.777 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.0 tt0 -62.32 -41.89 98.92 Favored 'General case' 0 N--CA 1.495 1.791 0 C-N-CA 119.988 -0.685 . . . . 2.1 110.836 -177.827 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.94 -43.96 70.54 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.246 -0.909 . . . . 0.19 111.454 -178.514 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 24.6 m -65.3 -39.99 93.23 Favored 'General case' 0 N--CA 1.492 1.636 0 O-C-N 121.088 -1.007 . . . . 0.2 109.883 -178.76 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . 0.402 ' O ' ' N ' ' A' ' 105' ' ' VAL . 63.9 mt -61.52 -48.54 88.31 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.883 0 N-CA-C 108.002 -1.11 . . . . 0.16 108.002 179.235 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.46 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.9 t-20 -60.2 -36.36 77.48 Favored 'General case' 0 C--N 1.302 -1.497 0 N-CA-C 108.409 -0.96 . . . . 0.95 108.409 178.727 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 6.0 tm-20 -67.15 -38.59 85.75 Favored 'General case' 0 C--N 1.301 -1.532 0 N-CA-C 109.637 -0.505 . . . . 2.21 109.637 -178.984 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.685 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.9 mt -99.86 -3.15 33.15 Favored 'General case' 0 N--CA 1.504 2.271 0 O-C-N 121.126 -0.984 . . . . 0.25 111.626 -179.042 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.46 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.7 p . . . . . 0 N--CA 1.497 1.919 0 O-C-N 120.397 -1.439 . . . . 1.08 109.119 -179.518 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo . . . . . 0 N--CA 1.496 1.669 0 CA-C-O 120.946 0.311 . . . . 1.46 112.361 . . . . . . . . . 0 0 . 1 . 031 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.25 126.54 34.89 Favored 'General case' 0 N--CA 1.495 1.806 0 O-C-N 121.199 -0.938 . . . . 0.88 109.144 179.592 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 44.0 p -118.58 158.23 25.83 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.298 -0.876 . . . . 0.7 109.274 -179.954 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.0 mt -64.09 -19.98 65.64 Favored 'General case' 0 N--CA 1.496 1.851 0 N-CA-C 108.983 -0.747 . . . . 0.61 108.983 178.97 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 42.2 mmtm -60.78 -25.0 66.22 Favored 'General case' 0 C--N 1.298 -1.674 0 O-C-N 121.428 -0.795 . . . . 1.31 110.228 -179.433 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.527 HD11 ' HA2' ' A' ' 91' ' ' GLY . 26.3 mm -129.92 146.99 33.28 Favored 'Isoleucine or valine' 0 N--CA 1.51 2.538 0 N-CA-C 109.543 -0.539 . . . . 0.15 109.543 -179.968 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 60.9 m -104.59 126.27 51.52 Favored 'General case' 0 N--CA 1.502 2.17 0 N-CA-C 107.176 -1.416 . . . . 0.19 107.176 177.848 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 70.0 m -77.46 138.18 39.09 Favored 'General case' 0 N--CA 1.503 2.19 0 O-C-N 120.672 -1.267 . . . . 0.2 111.016 -178.567 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.44 ' C ' ' N ' ' B' ' 69' ' ' VAL . 19.8 m95 -75.05 -9.63 58.72 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.012 -1.055 . . . . 0.21 109.556 179.056 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -52.63 -11.92 0.25 Allowed 'General case' 0 C--N 1.3 -1.55 0 O-C-N 121.335 -0.853 . . . . 0.49 109.122 -179.891 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.44 ' N ' ' C ' ' B' ' 67' ' ' TRP . 17.3 m -59.85 136.91 22.97 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.589 0 O-C-N 121.267 -0.896 . . . . 1.04 108.852 179.403 . . . . . . . . 2 2 . 1 . 031 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 45.0 m-20 -60.36 -35.48 75.77 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.545 -0.722 . . . . 1.36 109.65 -179.098 . . . . . . . . 1 1 . 1 . 031 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.242 0 CA-C-O 118.001 -1.444 . . . . 2.32 109.582 179.911 . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.3 mmt . . . . . 0 N--CA 1.489 1.489 0 CA-C-O 121.267 0.556 . . . . 2.88 109.598 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 80.1 t -98.71 143.21 13.52 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.024 0 O-C-N 121.454 -0.779 . . . . 0.45 109.572 -179.679 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 21.9 tptm -130.58 129.85 43.3 Favored 'General case' 0 N--CA 1.496 1.844 0 N-CA-C 108.238 -1.023 . . . . 1.67 108.238 179.94 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.4 tt0 -98.13 124.52 42.71 Favored 'General case' 0 N--CA 1.496 1.855 0 O-C-N 121.21 -0.931 . . . . 0.31 108.96 179.566 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 24.2 mm -100.92 113.83 38.12 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.621 0 O-C-N 121.389 -0.819 . . . . 0.19 108.824 179.165 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -98.47 -0.38 43.56 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.318 -0.864 . . . . 2.25 109.395 179.077 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.8 p -154.33 155.7 35.57 Favored 'General case' 0 N--CA 1.501 2.095 0 O-C-N 120.971 -1.081 . . . . 0.15 111.324 179.587 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.1 ttpt -62.66 -30.92 71.74 Favored 'General case' 0 N--CA 1.49 1.561 0 N-CA-C 108.247 -1.02 . . . . 1.65 108.247 178.478 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 59.1 m -59.02 -48.7 80.65 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 119.35 -0.94 . . . . 0.23 108.701 -179.573 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.14 -28.8 67.62 Favored 'General case' 0 C--N 1.299 -1.617 0 C-N-CA 119.85 -0.74 . . . . 0.17 109.067 179.079 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.478 ' CE2' HD11 ' A' ' 15' ' ' LEU . 45.0 t80 -59.89 -43.84 94.55 Favored 'General case' 0 C--N 1.304 -1.389 0 O-C-N 121.097 -1.002 . . . . 0.14 108.568 -179.683 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 28.7 mm100 -66.89 -42.17 85.97 Favored 'General case' 0 C--N 1.295 -1.772 0 N-CA-C 109.312 -0.625 . . . . 1.31 109.312 179.869 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 79.5 mm-40 -64.8 -37.14 86.6 Favored 'General case' 0 N--CA 1.492 1.632 0 CA-C-O 121.43 0.633 . . . . 1.77 110.046 -179.814 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.82 -43.06 80.5 Favored 'General case' 0 C--N 1.3 -1.564 0 O-C-N 121.289 -0.882 . . . . 0.15 108.999 -179.696 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.478 HD11 ' CE2' ' A' ' 11' ' ' PHE . 71.2 mt -61.02 -39.84 91.3 Favored 'General case' 0 N--CA 1.486 1.333 0 O-C-N 121.108 -0.995 . . . . 0.17 108.917 179.528 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 42.4 t0 -69.65 -35.27 75.03 Favored 'General case' 0 C--N 1.302 -1.495 0 O-C-N 121.532 -0.73 . . . . 1.07 110.2 -179.629 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -70.05 -37.5 75.57 Favored 'General case' 0 N--CA 1.496 1.857 0 O-C-N 121.341 -0.849 . . . . 0.18 110.801 -178.952 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -62.21 -32.11 72.73 Favored 'General case' 0 N--CA 1.493 1.714 0 O-C-N 121.098 -1.002 . . . . 0.17 109.757 -179.503 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.86 -124.22 20.23 Favored Glycine 0 N--CA 1.489 2.208 0 N-CA-C 110.24 -1.144 . . . . 0.2 110.24 -179.885 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . 0.402 ' OD1' ' NZ ' ' A' ' 82' ' ' LYS . 70.7 m-20 -90.7 1.76 56.56 Favored 'General case' 0 N--CA 1.496 1.851 0 O-C-N 121.157 -1.201 . . . . 1.07 110.554 -178.48 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 54.9 mtmt -75.73 150.12 37.89 Favored 'General case' 0 N--CA 1.493 1.701 0 O-C-N 121.014 -1.054 . . . . 1.5 110.251 -178.807 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.693 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -60.93 154.26 22.81 Favored 'General case' 0 N--CA 1.484 1.252 0 N-CA-C 107.605 -1.257 . . . . 0.47 107.605 -179.665 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.693 ' H ' HD23 ' A' ' 22' ' ' LEU . 90.4 t -144.41 116.13 2.43 Favored 'Isoleucine or valine' 0 C--N 1.302 -1.48 0 O-C-N 121.057 -1.027 . . . . 0.17 108.646 -179.664 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 44.2 t -105.08 142.6 17.92 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.694 0 N-CA-C 107.959 -1.126 . . . . 0.14 107.959 179.497 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . 0.4 ' CG1' HG21 ' A' ' 57' ' ' VAL . 21.7 t -125.31 123.17 64.51 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.262 0 O-C-N 121.179 -0.951 . . . . 0.13 109.514 -179.233 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.558 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 32.8 t70 -100.64 120.07 39.51 Favored 'General case' 0 N--CA 1.499 1.992 0 O-C-N 121.343 -0.848 . . . . 1.05 110.427 179.303 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 71.3 m-85 -97.29 25.58 5.47 Favored 'General case' 0 N--CA 1.502 2.133 0 O-C-N 121.335 -0.853 . . . . 0.73 110.336 179.315 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 52.3 m -59.47 146.62 39.63 Favored 'General case' 0 C--N 1.297 -1.693 0 O-C-N 120.923 -1.111 . . . . 0.3 110.061 -178.662 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.588 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -83.15 126.84 33.04 Favored 'General case' 0 C--N 1.305 -1.339 0 N-CA-C 107.699 -1.223 . . . . 0.22 107.699 179.34 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.9 t -68.06 -34.92 77.34 Favored 'General case' 0 C--N 1.297 -1.682 0 C-N-CA 119.148 -1.021 . . . . 0.3 108.365 -179.841 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.588 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 53.8 p-90 -69.86 -22.34 63.27 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.43 -0.794 . . . . 0.26 110.539 179.576 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.7 t -85.11 106.49 16.61 Favored 'General case' 0 N--CA 1.489 1.51 0 N-CA-C 107.526 -1.287 . . . . 0.26 107.526 179.695 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.518 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -58.83 -46.85 92.92 Favored Glycine 0 N--CA 1.487 2.08 0 C-N-CA 120.363 -0.922 . . . . 0.23 111.084 -178.469 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.518 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.5 Cg_exo -52.35 -36.21 67.82 Favored 'Trans proline' 0 C--N 1.311 -1.436 0 CA-C-N 118.942 1.371 . . . . 0.31 111.663 179.682 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -78.16 -49.4 13.92 Favored 'General case' 0 N--CA 1.49 1.553 0 O-C-N 121.493 -0.754 . . . . 0.24 109.954 179.98 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 82.1 tttt -59.9 -31.55 69.91 Favored 'General case' 0 N--CA 1.493 1.69 0 O-C-N 121.232 -0.918 . . . . 1.59 109.276 179.894 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.519 ' SD ' ' O ' ' A' ' 37' ' ' MET . 12.7 tmm? -59.91 -29.79 68.6 Favored 'General case' 0 C--N 1.298 -1.64 0 O-C-N 121.252 -0.905 . . . . 2.1 109.587 -179.465 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 14.8 mt -81.55 -8.15 11.16 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.857 0 O-C-N 121.532 -0.73 . . . . 0.49 111.34 -179.186 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.517 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 11.5 ptmt -61.67 -28.38 3.95 Favored Pre-proline 0 N--CA 1.494 1.743 0 O-C-N 120.27 -1.519 . . . . 0.8 113.621 -177.253 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.517 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 34.9 Cg_exo -57.63 -37.84 95.51 Favored 'Trans proline' 0 N--CA 1.493 1.448 0 CA-C-N 122.696 1.999 . . . . 0.28 112.178 -176.828 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 47.3 m-85 -68.57 -47.72 66.07 Favored 'General case' 0 C--N 1.303 -1.417 0 C-N-CA 118.601 -1.24 . . . . 0.37 108.113 179.306 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 89.9 t80 -60.34 -52.12 66.6 Favored 'General case' 0 C--N 1.303 -1.439 0 O-C-N 121.669 -0.644 . . . . 0.16 109.674 178.752 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 38.5 t60 -68.2 -40.28 82.2 Favored 'General case' 0 N--CA 1.491 1.612 0 O-C-N 121.478 -0.764 . . . . 0.32 110.836 -179.724 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.42 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.9 m -62.81 -39.08 93.18 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 120.952 -1.093 . . . . 0.22 110.666 -179.802 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.5 mt -63.18 -23.9 67.64 Favored 'General case' 0 N--CA 1.496 1.854 0 O-C-N 121.163 -0.961 . . . . 0.22 111.044 -178.383 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.7 m -53.33 -36.78 61.66 Favored 'General case' 0 C--N 1.3 -1.571 0 O-C-N 120.712 -1.243 . . . . 0.16 108.699 -179.18 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 50.2 mp0 -87.24 -14.02 42.2 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.267 -0.896 . . . . 2.16 109.179 179.395 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 59.9 tttp -79.29 -38.07 36.23 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 107.152 -1.425 . . . . 1.78 107.152 178.908 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 76.3 m-85 -121.74 68.28 0.91 Allowed 'General case' 0 N--CA 1.495 1.806 0 N-CA-C 106.856 -1.535 . . . . 0.25 106.856 178.002 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.66 -9.07 12.0 Favored 'General case' 0 C--N 1.306 -1.321 0 N-CA-C 108.748 -0.834 . . . . 0.22 108.748 -179.331 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 32.0 t30 -89.04 7.18 36.19 Favored 'General case' 0 N--CA 1.488 1.434 0 N-CA-C 107.875 -1.157 . . . . 1.13 107.875 178.861 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 44.9 t -127.45 144.82 36.16 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.695 0 N-CA-C 107.791 -1.189 . . . . 0.24 107.791 178.777 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 29.6 mm -100.02 121.05 50.26 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.172 0 O-C-N 121.027 -1.046 . . . . 0.15 109.419 -178.804 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.568 ' C ' HD12 ' A' ' 55' ' ' LEU . 35.6 m-85 -102.06 125.54 48.77 Favored 'General case' 0 N--CA 1.504 2.252 0 O-C-N 121.16 -0.963 . . . . 0.12 109.2 179.266 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.592 HD12 ' N ' ' A' ' 55' ' ' LEU . 6.7 mp -108.63 140.87 41.39 Favored 'General case' 0 N--CA 1.505 2.296 0 O-C-N 121.04 -1.038 . . . . 0.22 109.361 179.613 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.3 tt0 -108.92 132.07 54.42 Favored 'General case' 0 C--N 1.303 -1.425 0 N-CA-C 106.273 -1.751 . . . . 1.13 106.273 177.978 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . 0.4 HG21 ' CG1' ' A' ' 25' ' ' VAL . 42.5 t -130.72 133.61 63.09 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.152 0 O-C-N 121.295 -0.878 . . . . 0.15 110.76 -177.659 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.614 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 57.0 t0 -96.02 119.0 33.73 Favored 'General case' 0 N--CA 1.492 1.651 0 N-CA-C 108.865 -0.791 . . . . 1.05 108.865 179.681 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 26.9 m -68.25 -16.82 21.5 Favored 'Isoleucine or valine' 0 C--N 1.299 -1.625 0 O-C-N 120.524 -1.36 . . . . 0.16 108.784 179.319 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.54 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.3 m-20 -94.78 -40.19 9.89 Favored 'General case' 0 N--CA 1.496 1.845 0 O-C-N 121.433 -0.792 . . . . 1.08 111.623 -178.467 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 40.3 m-20 -98.09 -15.46 19.97 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 120.826 -1.171 . . . . 1.07 107.938 179.266 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.614 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -123.89 38.47 4.18 Favored 'General case' 0 N--CA 1.489 1.515 0 N-CA-C 107.621 -1.251 . . . . 0.14 107.621 179.389 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 20.7 pt20 -59.88 -27.74 66.96 Favored 'General case' 0 C--N 1.3 -1.56 0 O-C-N 121.731 -0.605 . . . . 1.47 109.859 -178.608 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.548 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.9 p30 -64.03 -36.0 82.55 Favored 'General case' 0 C--N 1.304 -1.397 0 O-C-N 120.686 -1.259 . . . . 1.05 109.155 179.591 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.548 HG23 ' OD1' ' A' ' 64' ' ' ASP . 5.7 t -71.76 -44.06 69.03 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.465 0 O-C-N 121.309 -0.869 . . . . 0.35 109.622 179.914 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.99 -39.75 69.04 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 121.384 -0.822 . . . . 0.26 110.287 -179.187 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -60.11 -30.47 69.28 Favored 'General case' 0 N--CA 1.488 1.427 0 O-C-N 121.197 -0.94 . . . . 0.24 108.97 -179.442 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 68.1 tt0 -60.54 -39.92 89.64 Favored 'General case' 0 C--N 1.303 -1.448 0 N-CA-C 108.909 -0.775 . . . . 2.06 108.909 178.881 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.439 ' CB ' HE22 ' A' ' 78' ' ' GLN . . . -91.46 0.93 57.45 Favored 'General case' 0 N--CA 1.493 1.724 0 O-C-N 121.28 -0.887 . . . . 0.23 110.717 -179.309 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 75.3 mm-40 55.76 49.97 15.14 Favored 'General case' 0 N--CA 1.495 1.808 0 O-C-N 120.992 -1.068 . . . . 2.02 109.134 -178.945 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 29.0 t -62.8 130.51 27.46 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 C-N-CA 118.323 -1.351 . . . . 0.16 108.363 -178.924 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 30.2 mmtp -102.22 -10.63 19.41 Favored 'General case' 0 N--CA 1.488 1.463 0 O-C-N 121.656 -0.652 . . . . 1.6 109.889 -178.933 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.483 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.47 156.09 18.24 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 120.698 -1.251 . . . . 0.14 111.129 179.629 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.1 p -126.79 155.66 74.93 Favored Pre-proline 0 N--CA 1.497 1.903 0 N-CA-C 107.699 -1.222 . . . . 0.15 107.699 178.309 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 30.7 Cg_endo -76.84 140.1 63.24 Favored 'Cis proline' 0 N--CA 1.492 1.411 0 C-N-CA 123.63 -1.404 . . . . 0.16 112.271 -2.275 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.483 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 95.0 m -125.14 132.52 53.07 Favored 'General case' 0 N--CA 1.494 1.757 0 N-CA-C 108.816 -0.809 . . . . 0.13 108.816 177.799 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.558 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 93.4 m-85 -110.51 131.4 55.08 Favored 'General case' 0 C--N 1.299 -1.618 0 N-CA-C 108.752 -0.832 . . . . 0.2 108.752 -179.867 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.439 HE22 ' CB ' ' A' ' 69' ' ' ALA . 74.8 mt-30 -122.89 139.13 54.37 Favored 'General case' 0 N--CA 1.499 1.999 0 O-C-N 121.322 -0.861 . . . . 0.29 109.11 179.465 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 71.2 m-85 -105.12 136.21 45.03 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-O 121.332 0.586 . . . . 0.14 110.401 -179.392 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 80.9 m-85 -129.07 146.99 50.89 Favored 'General case' 0 N--CA 1.49 1.574 0 N-CA-C 109.258 -0.645 . . . . 0.15 109.258 179.362 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 34.9 ttmt -145.93 122.67 11.21 Favored 'General case' 0 N--CA 1.493 1.711 0 N-CA-C 107.615 -1.254 . . . . 1.68 107.615 -179.995 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . 0.402 ' NZ ' ' OD1' ' A' ' 20' ' ' ASP . 55.3 mttm 56.71 34.49 24.68 Favored 'General case' 0 N--CA 1.496 1.826 0 O-C-N 120.998 -1.064 . . . . 1.22 109.043 -177.945 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 74.22 20.44 79.65 Favored Glycine 0 N--CA 1.483 1.783 0 N-CA-C 109.894 -1.282 . . . . 0.23 109.894 179.675 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -123.96 132.13 53.67 Favored 'General case' 0 N--CA 1.501 2.125 0 O-C-N 121.369 -1.077 . . . . 2.07 110.794 -179.655 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 82.9 tttt -79.02 124.01 27.86 Favored 'General case' 0 N--CA 1.495 1.82 0 O-C-N 121.422 -0.799 . . . . 1.82 109.021 178.923 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 17.2 m -123.82 9.27 5.0 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.924 0 O-C-N 121.656 -0.652 . . . . 0.3 110.977 -179.634 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.85 155.43 15.53 Favored Glycine 0 N--CA 1.495 2.586 0 C-N-CA 118.244 -1.931 . . . . 0.17 111.569 -179.616 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 4.5 tm-20 -166.78 148.73 6.28 Favored 'General case' 0 N--CA 1.49 1.572 0 O-C-N 121.818 -0.813 . . . . 1.93 109.549 179.512 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.429 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 10.4 p90 -163.91 159.5 21.01 Favored 'General case' 0 N--CA 1.492 1.635 0 O-C-N 121.34 -0.85 . . . . 0.14 109.377 178.348 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.3 p -125.79 162.31 25.4 Favored 'General case' 0 N--CA 1.495 1.818 0 N-CA-C 109.044 -0.724 . . . . 0.12 109.044 -179.525 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.448 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 122.11 139.78 5.67 Favored Glycine 0 N--CA 1.495 2.599 0 N-CA-C 109.586 -1.406 . . . . 0.12 109.586 179.831 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.27 63.6 1.93 Allowed 'General case' 0 C--N 1.301 -1.504 0 O-C-N 121.453 -1.028 . . . . 0.18 110.338 -179.64 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . 0.428 ' OD1' ' N ' ' A' ' 96' ' ' LYS . 21.2 t-20 -119.12 99.93 7.02 Favored 'General case' 0 N--CA 1.5 2.034 0 N-CA-C 108.531 -0.914 . . . . 0.88 108.531 178.541 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.438 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.1 OUTLIER -69.8 -31.43 69.33 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.333 -0.854 . . . . 1.06 111.597 -179.201 . . . . . . . . 3 3 . 1 . 032 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 92.5 mt-10 -66.14 -28.87 69.12 Favored 'General case' 0 N--CA 1.488 1.437 0 O-C-N 120.779 -1.201 . . . . 1.61 109.763 -179.589 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . 0.428 ' N ' ' OD1' ' A' ' 93' ' ' ASN . 77.1 tttt -61.19 -34.97 75.92 Favored 'General case' 0 C--N 1.298 -1.671 0 N-CA-C 108.655 -0.868 . . . . 1.45 108.655 -179.432 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.1 mt -59.97 -39.85 87.08 Favored 'General case' 0 C--N 1.303 -1.437 0 CA-C-O 122.124 0.964 . . . . 0.19 108.478 179.01 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -61.18 -41.46 96.83 Favored 'General case' 0 C--N 1.294 -1.845 0 CA-C-N 115.853 -0.612 . . . . 2.1 111.293 -178.115 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -68.99 -44.36 73.0 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 120.851 -1.156 . . . . 0.19 112.168 -178.082 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.9 m -66.56 -39.7 88.64 Favored 'General case' 0 C--N 1.301 -1.537 0 O-C-N 120.73 -1.232 . . . . 0.2 110.142 -178.485 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.4 mt -60.18 -50.59 79.62 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.743 0 O-C-N 121.106 -0.996 . . . . 0.16 108.699 179.897 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.495 ' O ' HG12 ' A' ' 105' ' ' VAL . 65.4 t30 -61.5 -33.62 74.1 Favored 'General case' 0 C--N 1.297 -1.677 0 N-CA-C 108.694 -0.854 . . . . 0.95 108.694 179.189 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.0 tp10 -68.1 -41.38 81.89 Favored 'General case' 0 C--N 1.301 -1.51 0 O-C-N 121.529 -0.732 . . . . 2.21 110.69 -178.956 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.624 ' HB2' HD11 ' A' ' 22' ' ' LEU . 91.4 mt -97.64 -2.14 42.15 Favored 'General case' 0 N--CA 1.495 1.802 0 O-C-N 121.22 -0.925 . . . . 0.25 110.951 -178.683 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.495 HG12 ' O ' ' A' ' 102' ' ' ASN . 6.2 p . . . . . 0 N--CA 1.493 1.722 0 O-C-N 120.624 -1.298 . . . . 1.08 109.222 -179.526 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 53.8 Cg_exo . . . . . 0 N--CA 1.494 1.517 0 CA-C-O 121.399 0.5 . . . . 1.46 111.865 . . . . . . . . . 0 0 . 1 . 032 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -93.61 123.72 37.12 Favored 'General case' 0 N--CA 1.494 1.753 0 O-C-N 121.347 -0.846 . . . . 0.88 109.069 179.883 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.431 HG22 ' H ' ' B' ' 63' ' ' LYS . 21.2 m -104.5 129.74 52.5 Favored 'General case' 0 N--CA 1.501 2.088 0 O-C-N 121.377 -0.827 . . . . 0.7 109.637 -179.741 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.7 mt -66.71 -29.99 70.12 Favored 'General case' 0 N--CA 1.492 1.637 0 O-C-N 121.235 -0.915 . . . . 0.61 109.472 179.581 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.431 ' H ' HG22 ' B' ' 61' ' ' THR . 60.3 mmtt -60.64 -17.49 47.63 Favored 'General case' 0 N--CA 1.491 1.623 0 O-C-N 121.393 -0.817 . . . . 1.31 109.256 -179.2 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.448 HD11 ' HA2' ' A' ' 91' ' ' GLY . 38.5 mm -128.83 140.37 49.43 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.428 0 N-CA-C 109.411 -0.589 . . . . 0.15 109.411 179.845 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 13.8 m -100.97 126.79 47.65 Favored 'General case' 0 N--CA 1.501 2.115 0 N-CA-C 107.492 -1.299 . . . . 0.19 107.492 177.549 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 67.8 m -79.01 140.82 37.87 Favored 'General case' 0 N--CA 1.5 2.035 0 O-C-N 120.781 -1.2 . . . . 0.2 110.909 -178.512 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.474 ' C ' ' N ' ' B' ' 69' ' ' VAL . 22.1 m95 -74.27 -10.01 59.18 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.264 -0.898 . . . . 0.21 109.578 179.499 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.7 -12.37 0.19 Allowed 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.137 -0.977 . . . . 0.49 108.457 -179.869 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.474 ' N ' ' C ' ' B' ' 67' ' ' TRP . 21.2 m -64.09 146.19 13.25 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.378 0 O-C-N 121.449 -0.782 . . . . 1.04 109.198 179.425 . . . . . . . . 2 2 . 1 . 032 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -60.28 -41.0 92.39 Favored 'General case' 0 N--CA 1.495 1.816 0 O-C-N 121.13 -0.981 . . . . 1.36 109.806 -179.497 . . . . . . . . 1 1 . 1 . 032 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.381 0 CA-C-O 117.964 -1.465 . . . . 2.32 109.735 -179.842 . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 85.2 mmm . . . . . 0 N--CA 1.49 1.554 0 N-CA-C 109.27 -0.641 . . . . 2.88 109.27 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 90.0 t -99.08 147.0 7.43 Favored 'Isoleucine or valine' 0 N--CA 1.502 2.131 0 O-C-N 121.204 -0.935 . . . . 0.45 109.468 -179.837 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 61.2 tttp -129.94 125.52 35.66 Favored 'General case' 0 N--CA 1.496 1.85 0 N-CA-C 108.81 -0.811 . . . . 1.67 108.81 -179.778 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.2 tt0 -97.86 126.1 43.07 Favored 'General case' 0 N--CA 1.492 1.67 0 N-CA-C 108.237 -1.023 . . . . 0.31 108.237 179.464 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 39.4 mm -100.04 112.06 31.47 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 N-CA-C 108.262 -1.014 . . . . 0.19 108.262 179.795 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 24.0 mm-40 -96.48 -0.38 49.11 Favored 'General case' 0 N--CA 1.491 1.585 0 O-C-N 121.13 -0.981 . . . . 2.25 109.727 -179.655 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.9 p -153.19 155.43 36.66 Favored 'General case' 0 N--CA 1.495 1.814 0 O-C-N 120.967 -1.083 . . . . 0.15 110.841 179.765 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 30.3 ttpt -64.25 -33.34 75.6 Favored 'General case' 0 N--CA 1.486 1.357 0 N-CA-C 107.981 -1.118 . . . . 1.65 107.981 178.545 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 37.1 m -57.08 -48.23 79.1 Favored 'General case' 0 C--N 1.3 -1.568 0 N-CA-C 108.49 -0.93 . . . . 0.23 108.49 -179.361 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -68.22 -29.25 68.04 Favored 'General case' 0 C--N 1.301 -1.528 0 O-C-N 121.373 -0.83 . . . . 0.17 109.125 178.942 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.472 ' CE2' HD11 ' A' ' 15' ' ' LEU . 48.4 t80 -60.04 -44.64 94.52 Favored 'General case' 0 N--CA 1.496 1.848 0 O-C-N 121.182 -0.949 . . . . 0.14 108.731 -179.942 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.9 mm-40 -65.38 -43.57 90.29 Favored 'General case' 0 C--N 1.297 -1.704 0 C-N-CA 119.64 -0.824 . . . . 1.31 109.031 179.631 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.2 mm-40 -64.8 -36.34 84.02 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.4 -0.813 . . . . 1.77 110.282 179.383 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.0 -43.24 79.34 Favored 'General case' 0 C--N 1.304 -1.377 0 O-C-N 121.454 -0.779 . . . . 0.15 108.975 -179.503 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.472 HD11 ' CE2' ' A' ' 11' ' ' PHE . 76.2 mt -60.37 -40.22 90.07 Favored 'General case' 0 C--N 1.303 -1.416 0 N-CA-C 108.027 -1.101 . . . . 0.17 108.027 179.709 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 11.8 t70 -69.32 -34.64 74.95 Favored 'General case' 0 N--CA 1.49 1.53 0 O-C-N 121.281 -0.887 . . . . 1.07 109.861 179.841 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.2 -36.24 79.26 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.45 -0.781 . . . . 0.18 110.472 -179.109 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.12 -30.75 71.8 Favored 'General case' 0 N--CA 1.493 1.677 0 O-C-N 121.215 -0.928 . . . . 0.17 109.208 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.43 -126.44 25.1 Favored Glycine 0 N--CA 1.485 1.93 0 N-CA-C 109.358 -1.497 . . . . 0.2 109.358 -179.618 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 73.4 m-20 -91.69 3.54 54.83 Favored 'General case' 0 N--CA 1.494 1.765 0 O-C-N 121.32 -1.106 . . . . 1.07 110.804 -179.273 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.5 mttt -74.86 149.45 39.55 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 120.663 -1.273 . . . . 1.5 108.995 179.988 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.687 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.59 160.14 5.82 Favored 'General case' 0 N--CA 1.491 1.588 0 N-CA-C 106.992 -1.484 . . . . 0.47 106.992 179.369 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.687 ' H ' HD23 ' A' ' 22' ' ' LEU . 95.7 t -147.5 119.63 1.69 Allowed 'Isoleucine or valine' 0 C--N 1.303 -1.414 0 O-C-N 120.962 -1.086 . . . . 0.17 108.321 179.854 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.416 HG22 ' CE2' ' A' ' 79' ' ' PHE . 45.4 t -106.91 142.0 20.78 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 N-CA-C 107.721 -1.214 . . . . 0.14 107.721 179.267 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 43.9 t -124.64 120.2 58.24 Favored 'Isoleucine or valine' 0 N--CA 1.499 1.983 0 O-C-N 121.349 -0.844 . . . . 0.13 108.913 -179.846 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . 0.567 ' OD1' ' CE1' ' A' ' 77' ' ' PHE . 30.4 t70 -98.61 108.71 21.47 Favored 'General case' 0 N--CA 1.493 1.694 0 O-C-N 121.331 -0.856 . . . . 1.05 111.628 -179.319 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.4 m-85 -90.1 101.01 13.73 Favored 'General case' 0 N--CA 1.488 1.44 0 N-CA-C 106.4 -1.704 . . . . 0.73 106.4 176.602 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 55.3 m -129.94 145.59 51.63 Favored 'General case' 0 N--CA 1.494 1.743 0 N-CA-C 107.955 -1.128 . . . . 0.3 107.955 -179.66 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.773 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.15 122.98 29.59 Favored 'General case' 0 C--N 1.299 -1.616 0 N-CA-C 107.567 -1.272 . . . . 0.22 107.567 179.474 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 7.7 t -63.3 -29.3 70.65 Favored 'General case' 0 C--N 1.298 -1.666 0 N-CA-C 107.887 -1.153 . . . . 0.3 107.887 -179.859 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.773 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 69.6 p-90 -78.97 -10.95 59.98 Favored 'General case' 0 N--CA 1.491 1.598 0 O-C-N 121.475 -0.766 . . . . 0.26 111.144 -179.887 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . 0.463 ' HB2' ' HB3' ' A' ' 29' ' ' ALA . 34.6 t -87.63 116.29 25.65 Favored 'General case' 0 N--CA 1.494 1.747 0 O-C-N 120.709 -1.244 . . . . 0.26 108.53 -179.674 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.467 ' N ' ' HD2' ' A' ' 34' ' ' PRO . . . -60.47 -52.81 50.29 Favored Glycine 0 N--CA 1.487 2.068 0 C-N-CA 120.84 -0.695 . . . . 0.23 112.002 -178.472 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.467 ' HD2' ' N ' ' A' ' 33' ' ' GLY . 7.6 Cg_endo -60.33 -28.87 87.66 Favored 'Trans proline' 0 N--CA 1.488 1.165 0 CA-C-N 119.742 1.771 . . . . 0.31 113.148 -179.685 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.89 -47.46 21.11 Favored 'General case' 0 N--CA 1.496 1.871 0 O-C-N 120.721 -1.237 . . . . 0.24 110.018 -179.735 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 83.2 tttt -59.98 -32.27 70.69 Favored 'General case' 0 N--CA 1.49 1.565 0 O-C-N 121.293 -0.879 . . . . 1.59 109.411 179.601 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.501 ' SD ' ' O ' ' A' ' 37' ' ' MET . 18.3 tmm? -60.11 -29.64 68.73 Favored 'General case' 0 N--CA 1.49 1.548 0 O-C-N 121.591 -0.693 . . . . 2.1 109.639 -179.934 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.443 HG22 ' O ' ' A' ' 38' ' ' ILE . 16.9 mt -81.59 -5.79 9.1 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.655 0 O-C-N 121.791 -0.568 . . . . 0.49 111.282 -179.107 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.559 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 0.0 OUTLIER -59.62 -31.04 8.52 Favored Pre-proline 0 N--CA 1.498 1.957 0 O-C-N 119.896 -1.753 . . . . 0.8 113.427 -177.927 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.559 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 23.1 Cg_exo -60.04 -40.54 60.32 Favored 'Trans proline' 0 N--CA 1.491 1.339 0 CA-C-N 121.297 1.499 . . . . 0.28 112.821 -178.204 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 44.1 m-85 -70.17 -47.91 59.56 Favored 'General case' 0 N--CA 1.487 1.393 0 O-C-N 120.746 -1.222 . . . . 0.37 108.673 179.798 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 87.7 t80 -60.58 -50.66 72.64 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 121.302 -0.874 . . . . 0.16 109.004 179.481 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 47.9 t60 -67.85 -40.24 83.7 Favored 'General case' 0 C--N 1.298 -1.632 0 O-C-N 121.699 -0.625 . . . . 0.32 111.276 179.187 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.414 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 75.3 m -63.58 -39.31 94.07 Favored 'General case' 0 N--CA 1.496 1.844 0 O-C-N 120.647 -1.283 . . . . 0.22 110.635 -179.342 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 35.3 mt -60.13 -27.15 66.83 Favored 'General case' 0 N--CA 1.493 1.697 0 O-C-N 121.396 -0.815 . . . . 0.22 110.909 -178.571 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 64.5 m -50.09 -37.5 34.14 Favored 'General case' 0 N--CA 1.491 1.593 0 O-C-N 120.975 -1.078 . . . . 0.16 108.986 179.963 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.522 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.2 mp0 -87.59 -16.75 33.66 Favored 'General case' 0 C--N 1.3 -1.587 0 O-C-N 121.205 -0.935 . . . . 2.16 108.942 179.698 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -77.73 -35.99 51.32 Favored 'General case' 0 N--CA 1.49 1.545 0 N-CA-C 107.316 -1.365 . . . . 1.78 107.316 179.462 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 77.4 m-85 -124.28 69.21 1.07 Allowed 'General case' 0 N--CA 1.495 1.801 0 N-CA-C 107.261 -1.385 . . . . 0.25 107.261 177.953 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.0 p -65.66 -8.97 23.39 Favored 'General case' 0 C--N 1.305 -1.369 0 N-CA-C 108.729 -0.841 . . . . 0.22 108.729 -179.511 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 25.0 t30 -91.13 10.15 28.12 Favored 'General case' 0 N--CA 1.493 1.697 0 N-CA-C 108.22 -1.03 . . . . 1.13 108.22 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 46.3 t -128.72 146.42 34.11 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.826 0 N-CA-C 107.706 -1.22 . . . . 0.24 107.706 179.149 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 24.1 mm -100.93 121.43 51.73 Favored 'Isoleucine or valine' 0 N--CA 1.505 2.314 0 O-C-N 120.818 -1.176 . . . . 0.15 109.78 -178.949 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.534 ' C ' HD12 ' A' ' 55' ' ' LEU . 45.6 m-85 -102.78 124.2 47.87 Favored 'General case' 0 N--CA 1.509 2.486 0 O-C-N 121.255 -0.903 . . . . 0.12 109.999 179.916 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.534 HD12 ' C ' ' A' ' 54' ' ' PHE . 4.2 mp -110.18 142.7 41.36 Favored 'General case' 0 N--CA 1.505 2.288 0 O-C-N 121.266 -0.896 . . . . 0.22 109.017 178.872 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 34.1 tt0 -113.02 130.32 56.18 Favored 'General case' 0 N--CA 1.491 1.603 0 N-CA-C 106.738 -1.578 . . . . 1.13 106.738 178.185 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 43.8 t -125.77 134.18 67.27 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.051 -1.031 . . . . 0.15 111.171 -177.777 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.701 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 53.5 t0 -98.97 119.44 37.75 Favored 'General case' 0 N--CA 1.492 1.673 0 N-CA-C 108.499 -0.926 . . . . 1.05 108.499 179.695 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.6 m -69.09 -17.7 22.13 Favored 'Isoleucine or valine' 0 C--N 1.292 -1.919 0 O-C-N 120.734 -1.229 . . . . 0.16 108.889 179.349 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.542 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 2.0 m-20 -92.64 -39.95 11.02 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.44 -0.788 . . . . 1.08 110.939 -179.079 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 47.6 m-20 -98.5 -12.25 21.47 Favored 'General case' 0 N--CA 1.503 2.225 0 O-C-N 120.864 -1.148 . . . . 1.07 107.935 178.976 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.701 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -127.58 39.33 3.9 Favored 'General case' 0 N--CA 1.492 1.65 0 N-CA-C 107.285 -1.376 . . . . 0.14 107.285 179.3 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 21.4 pt20 -59.78 -27.74 66.81 Favored 'General case' 0 C--N 1.296 -1.722 0 CA-C-N 115.868 -0.606 . . . . 1.47 109.385 -178.757 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.527 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.0 p30 -65.69 -38.14 88.41 Favored 'General case' 0 C--N 1.302 -1.486 0 O-C-N 121.187 -0.946 . . . . 1.05 109.329 179.353 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.527 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 8.9 t -69.72 -44.15 79.47 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.578 0 O-C-N 121.121 -0.987 . . . . 0.35 109.364 -179.917 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -71.36 -39.14 71.46 Favored 'General case' 0 C--N 1.301 -1.522 0 O-C-N 121.743 -0.598 . . . . 0.26 110.592 -179.036 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 99.8 p -61.17 -36.35 79.59 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.038 -1.039 . . . . 0.24 109.844 -179.01 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 14.5 tm-20 -61.98 -37.19 83.88 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.09 -1.006 . . . . 2.06 109.392 179.431 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -88.71 -0.88 57.73 Favored 'General case' 0 N--CA 1.495 1.783 0 O-C-N 121.342 -0.849 . . . . 0.23 111.364 -178.672 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.3 mm-40 56.3 52.2 10.49 Favored 'General case' 0 N--CA 1.496 1.853 0 O-C-N 121.203 -0.936 . . . . 2.02 109.438 -179.441 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 26.7 t -66.48 130.94 32.28 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.506 0 C-N-CA 118.371 -1.332 . . . . 0.16 108.575 -179.169 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 69.8 mmtt -104.06 -11.01 17.61 Favored 'General case' 0 C--N 1.306 -1.313 0 O-C-N 121.681 -0.637 . . . . 1.6 109.522 -179.422 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.416 ' CA ' ' HE1' ' B' ' 67' ' ' TRP . . . -163.54 154.28 16.1 Favored 'General case' 0 N--CA 1.491 1.584 0 O-C-N 120.878 -1.139 . . . . 0.14 110.938 179.906 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.8 p -129.63 156.08 79.31 Favored Pre-proline 0 N--CA 1.499 1.988 0 N-CA-C 106.828 -1.545 . . . . 0.15 106.828 178.447 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 26.3 Cg_endo -76.16 140.94 68.69 Favored 'Cis proline' 0 N--CA 1.49 1.292 0 C-N-CA 123.818 -1.326 . . . . 0.16 111.788 -3.04 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.41 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 92.9 m -128.46 135.1 49.0 Favored 'General case' 0 N--CA 1.498 1.932 0 N-CA-C 108.68 -0.859 . . . . 0.13 108.68 178.784 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.567 ' CE1' ' OD1' ' A' ' 26' ' ' ASP . 91.3 m-85 -108.83 128.83 55.24 Favored 'General case' 0 N--CA 1.493 1.691 0 N-CA-C 108.873 -0.788 . . . . 0.2 108.873 -179.43 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 -121.15 140.02 52.56 Favored 'General case' 0 N--CA 1.496 1.838 0 N-CA-C 107.62 -1.252 . . . . 0.29 107.62 178.773 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.416 ' CE2' HG22 ' A' ' 24' ' ' VAL . 69.6 m-85 -107.72 135.08 49.75 Favored 'General case' 0 N--CA 1.493 1.721 0 CA-C-O 121.257 0.551 . . . . 0.14 110.241 -178.942 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.9 m-85 -126.88 147.23 50.07 Favored 'General case' 0 N--CA 1.488 1.457 0 N-CA-C 109.165 -0.68 . . . . 0.15 109.165 178.985 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -146.16 125.08 12.72 Favored 'General case' 0 C--N 1.301 -1.505 0 N-CA-C 106.986 -1.487 . . . . 1.68 106.986 179.378 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 50.3 mttp 57.97 27.1 14.26 Favored 'General case' 0 C--N 1.3 -1.584 0 N-CA-C 108.099 -1.074 . . . . 1.22 108.099 -178.296 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . 0.451 ' C ' HE21 ' A' ' 84' ' ' GLN . . . 80.53 11.3 84.26 Favored Glycine 0 N--CA 1.492 2.398 0 N-CA-C 110.112 -1.195 . . . . 0.23 110.112 179.944 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . 0.451 HE21 ' C ' ' A' ' 83' ' ' GLY . 5.3 mm-40 -112.98 133.39 54.96 Favored 'General case' 0 N--CA 1.502 2.157 0 O-C-N 121.511 -0.994 . . . . 2.07 110.253 -179.26 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 38.4 ttmt -81.47 120.02 24.47 Favored 'General case' 0 N--CA 1.494 1.755 0 N-CA-C 108.583 -0.895 . . . . 1.82 108.583 178.858 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 28.6 m -121.76 13.01 5.95 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.681 0 O-C-N 121.857 -0.527 . . . . 0.3 110.517 -179.288 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -179.59 154.79 14.29 Favored Glycine 0 N--CA 1.496 2.687 0 C-N-CA 118.304 -1.903 . . . . 0.17 112.284 179.657 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 70.6 tt0 -167.2 150.6 6.46 Favored 'General case' 0 N--CA 1.49 1.545 0 O-C-N 121.656 -0.908 . . . . 1.93 109.816 179.397 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . . . . . . . . . 19.6 p90 -164.47 160.21 20.26 Favored 'General case' 0 N--CA 1.492 1.635 0 C-N-CA 119.284 -0.966 . . . . 0.14 109.102 177.082 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 78.9 p -125.77 161.49 27.23 Favored 'General case' 0 N--CA 1.502 2.137 0 O-C-N 121.445 -0.784 . . . . 0.12 110.52 -179.055 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.433 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.51 138.91 5.83 Favored Glycine 0 N--CA 1.492 2.386 0 N-CA-C 109.574 -1.41 . . . . 0.12 109.574 179.16 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -75.05 67.17 1.7 Allowed 'General case' 0 C--N 1.303 -1.416 0 O-C-N 121.269 -1.136 . . . . 0.18 109.765 -179.588 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -118.89 96.97 5.47 Favored 'General case' 0 N--CA 1.495 1.824 0 N-CA-C 108.813 -0.81 . . . . 0.88 108.813 178.877 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . 0.4 ' HD3' ' H ' ' A' ' 94' ' ' LYS . 0.0 OUTLIER -70.15 -33.43 71.78 Favored 'General case' 0 N--CA 1.497 1.916 0 O-C-N 121.173 -0.954 . . . . 1.06 111.72 -179.55 . . . . . . . . 3 3 . 1 . 033 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 74.8 mm-40 -62.97 -30.2 71.4 Favored 'General case' 0 C--N 1.3 -1.582 0 O-C-N 120.693 -1.255 . . . . 1.61 108.641 -179.85 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 13.5 ttmm -60.61 -36.59 78.96 Favored 'General case' 0 C--N 1.302 -1.499 0 CA-C-O 121.449 0.643 . . . . 1.45 109.498 -179.844 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . 0.472 HD21 ' CD1' ' A' ' 77' ' ' PHE . 39.7 mt -59.05 -37.94 78.21 Favored 'General case' 0 C--N 1.302 -1.46 0 CA-C-O 121.982 0.896 . . . . 0.19 108.624 179.886 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 15.1 tm-20 -62.89 -42.39 99.76 Favored 'General case' 0 C--N 1.295 -1.785 0 C-N-CA 120.128 -0.629 . . . . 2.1 110.851 -177.815 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -70.88 -43.47 68.31 Favored 'General case' 0 N--CA 1.494 1.745 0 O-C-N 121.051 -1.03 . . . . 0.19 111.655 -178.399 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 23.8 m -64.65 -39.95 94.58 Favored 'General case' 0 N--CA 1.491 1.597 0 O-C-N 120.701 -1.249 . . . . 0.2 110.506 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 51.4 mt -61.17 -48.89 86.91 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.784 0 N-CA-C 108.15 -1.055 . . . . 0.16 108.15 179.252 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.423 ' O ' HG12 ' A' ' 105' ' ' VAL . 23.0 t-20 -60.69 -34.03 73.74 Favored 'General case' 0 C--N 1.299 -1.606 0 N-CA-C 108.543 -0.91 . . . . 0.95 108.543 178.904 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 53.7 tt0 -68.01 -39.29 83.21 Favored 'General case' 0 C--N 1.303 -1.452 0 O-C-N 121.669 -0.645 . . . . 2.21 110.282 -178.883 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.66 ' HB2' HD11 ' A' ' 22' ' ' LEU . 92.5 mt -100.37 -3.72 30.56 Favored 'General case' 0 N--CA 1.497 1.883 0 O-C-N 121.407 -0.808 . . . . 0.25 110.978 -178.706 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.423 HG12 ' O ' ' A' ' 102' ' ' ASN . 5.4 p . . . . . 0 N--CA 1.495 1.803 0 O-C-N 120.552 -1.343 . . . . 1.08 108.658 -179.762 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo . . . . . 0 N--CA 1.495 1.576 0 CA-C-O 121.282 0.451 . . . . 1.46 112.023 . . . . . . . . . 0 0 . 1 . 033 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -94.44 119.64 33.46 Favored 'General case' 0 N--CA 1.492 1.663 0 O-C-N 121.303 -0.873 . . . . 0.88 108.967 179.484 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.427 HG22 ' H ' ' B' ' 63' ' ' LYS . 24.1 m -109.69 129.51 55.6 Favored 'General case' 0 N--CA 1.499 2.012 0 O-C-N 121.363 -0.835 . . . . 0.7 109.21 179.979 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 82.8 mt -67.18 -29.58 69.3 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 121.179 -0.95 . . . . 0.61 109.762 -179.923 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.427 ' H ' HG22 ' B' ' 61' ' ' THR . 60.6 mmtt -62.61 -18.12 61.57 Favored 'General case' 0 N--CA 1.492 1.664 0 O-C-N 121.338 -0.851 . . . . 1.31 108.873 -179.704 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.433 HD11 ' HA2' ' A' ' 91' ' ' GLY . 36.1 mm -127.97 140.69 48.48 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.271 0 N-CA-C 109.199 -0.667 . . . . 0.15 109.199 -179.954 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 4.5 m -97.56 122.39 40.58 Favored 'General case' 0 N--CA 1.5 2.073 0 N-CA-C 107.165 -1.42 . . . . 0.19 107.165 177.558 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 54.2 m -77.79 140.3 39.42 Favored 'General case' 0 N--CA 1.506 2.347 0 O-C-N 120.85 -1.156 . . . . 0.2 111.851 -178.081 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.47 ' C ' ' N ' ' B' ' 69' ' ' VAL . 26.3 m95 -74.7 -11.98 60.31 Favored 'General case' 0 N--CA 1.496 1.849 0 O-C-N 121.261 -0.9 . . . . 0.21 109.685 179.236 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . 0.414 ' N ' HD22 ' B' ' 68' ' ' ASN . 2.5 m120 -50.39 -13.16 0.11 Allowed 'General case' 0 N--CA 1.491 1.617 0 O-C-N 121.134 -0.979 . . . . 0.49 108.546 179.826 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.482 HG11 ' CH2' ' A' ' 31' ' ' TRP . 15.3 m -61.66 144.24 14.19 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.463 0 O-C-N 121.293 -0.879 . . . . 1.04 108.887 179.049 . . . . . . . . 2 2 . 1 . 033 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 52.4 m-20 -59.97 -41.3 91.64 Favored 'General case' 0 N--CA 1.492 1.643 0 O-C-N 121.018 -1.051 . . . . 1.36 109.756 -179.204 . . . . . . . . 1 1 . 1 . 033 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 2.393 0 CA-C-O 117.903 -1.498 . . . . 2.32 109.666 179.556 . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 49.2 ttm . . . . . 0 N--CA 1.489 1.516 0 N-CA-C 109.274 -0.639 . . . . 2.88 109.274 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 72.3 t -98.31 153.54 4.04 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.959 0 O-C-N 121.329 -0.857 . . . . 0.45 109.35 -179.766 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -129.96 129.78 44.22 Favored 'General case' 0 N--CA 1.495 1.779 0 N-CA-C 108.372 -0.973 . . . . 1.67 108.372 -179.798 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 63.0 tt0 -96.63 122.79 39.95 Favored 'General case' 0 N--CA 1.494 1.767 0 O-C-N 121.239 -0.913 . . . . 0.31 108.856 -179.876 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.7 mm -100.62 111.55 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.622 0 O-C-N 121.31 -0.869 . . . . 0.19 108.678 179.547 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.448 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.2 mp0 -96.55 0.5 50.18 Favored 'General case' 0 N--CA 1.486 1.374 0 O-C-N 121.15 -0.969 . . . . 2.25 109.884 -179.421 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 80.1 p -154.13 156.12 36.63 Favored 'General case' 0 N--CA 1.5 2.055 0 O-C-N 121.026 -1.046 . . . . 0.15 111.04 179.931 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . . . . . . . . . 29.9 ttpt -64.74 -33.29 75.63 Favored 'General case' 0 N--CA 1.487 1.422 0 N-CA-C 108.438 -0.949 . . . . 1.65 108.438 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 51.6 m -57.38 -46.31 83.55 Favored 'General case' 0 C--N 1.304 -1.404 0 N-CA-C 108.48 -0.933 . . . . 0.23 108.48 -179.136 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.48 -31.85 70.37 Favored 'General case' 0 C--N 1.298 -1.651 0 N-CA-C 108.903 -0.777 . . . . 0.17 108.903 178.689 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.508 ' CE2' HD11 ' A' ' 15' ' ' LEU . 51.4 t80 -58.52 -43.73 89.25 Favored 'General case' 0 N--CA 1.489 1.522 0 O-C-N 121.304 -0.873 . . . . 0.14 109.046 -179.527 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 30.3 mm100 -66.21 -42.76 88.29 Favored 'General case' 0 C--N 1.293 -1.888 0 C-N-CA 119.529 -0.868 . . . . 1.31 108.891 179.996 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 78.1 mm-40 -63.63 -39.51 94.53 Favored 'General case' 0 N--CA 1.493 1.704 0 O-C-N 121.644 -0.66 . . . . 1.77 110.82 179.752 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -68.18 -38.96 82.59 Favored 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.154 -0.966 . . . . 0.15 109.24 -179.659 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.508 HD11 ' CE2' ' A' ' 11' ' ' PHE . 79.7 mt -61.09 -40.15 92.63 Favored 'General case' 0 C--N 1.305 -1.342 0 N-CA-C 108.087 -1.079 . . . . 0.17 108.087 179.218 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -69.04 -37.13 78.41 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 121.769 -0.582 . . . . 1.07 110.513 179.72 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -68.09 -36.03 79.13 Favored 'General case' 0 N--CA 1.496 1.868 0 O-C-N 121.146 -0.971 . . . . 0.18 110.27 -178.924 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.29 -32.7 72.55 Favored 'General case' 0 N--CA 1.49 1.56 0 O-C-N 121.078 -1.014 . . . . 0.17 109.09 179.827 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 66.66 -124.02 23.45 Favored Glycine 0 N--CA 1.484 1.9 0 N-CA-C 109.417 -1.473 . . . . 0.2 109.417 -179.853 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 64.0 m-20 -92.14 3.89 54.34 Favored 'General case' 0 N--CA 1.493 1.684 0 O-C-N 121.242 -1.152 . . . . 1.07 110.983 -179.301 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 74.2 mttt -75.8 148.71 38.23 Favored 'General case' 0 N--CA 1.494 1.749 0 O-C-N 120.751 -1.218 . . . . 1.5 109.118 -179.914 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.683 HD11 ' HB2' ' A' ' 104' ' ' LEU . 0.4 OUTLIER -60.7 158.56 12.45 Favored 'General case' 0 N--CA 1.486 1.365 0 N-CA-C 107.137 -1.431 . . . . 0.47 107.137 179.759 . . . . . . . . 3 3 . 1 . 034 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.639 ' H ' HD23 ' A' ' 22' ' ' LEU . 44.1 t -146.24 119.2 2.22 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.45 0 O-C-N 120.651 -1.281 . . . . 0.17 108.732 179.654 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.439 HG22 ' CE2' ' A' ' 79' ' ' PHE . 21.5 t -106.52 140.99 22.84 Favored 'Isoleucine or valine' 0 N--CA 1.493 1.691 0 N-CA-C 107.664 -1.236 . . . . 0.14 107.664 179.045 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 38.6 t -123.54 121.95 63.83 Favored 'Isoleucine or valine' 0 N--CA 1.5 2.028 0 O-C-N 121.439 -0.788 . . . . 0.13 109.483 -179.075 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 62.5 t0 -100.14 120.26 39.6 Favored 'General case' 0 N--CA 1.5 2.051 0 O-C-N 121.493 -0.754 . . . . 1.05 109.919 179.883 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 65.7 m-85 -96.75 23.31 7.16 Favored 'General case' 0 N--CA 1.501 2.123 0 O-C-N 121.257 -0.902 . . . . 0.73 110.137 179.507 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . 0.464 ' HB3' ' HB1' ' A' ' 35' ' ' ALA . 52.0 m -57.43 146.26 30.08 Favored 'General case' 0 C--N 1.297 -1.679 0 O-C-N 121.032 -1.043 . . . . 0.3 110.639 -178.731 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.602 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.47 124.76 31.71 Favored 'General case' 0 N--CA 1.486 1.325 0 N-CA-C 107.709 -1.219 . . . . 0.22 107.709 178.991 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 9.4 t -67.9 -33.59 75.0 Favored 'General case' 0 C--N 1.301 -1.535 0 C-N-CA 118.657 -1.217 . . . . 0.3 108.453 -179.627 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.602 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 52.5 p-90 -70.04 -24.16 63.22 Favored 'General case' 0 N--CA 1.494 1.735 0 O-C-N 121.289 -0.882 . . . . 0.26 110.944 179.488 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 7.2 t -83.44 119.75 25.04 Favored 'General case' 0 N--CA 1.491 1.588 0 O-C-N 120.86 -1.15 . . . . 0.26 107.994 -179.456 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.449 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.58 -52.15 52.94 Favored Glycine 0 N--CA 1.49 2.241 0 C-N-CA 120.397 -0.906 . . . . 0.23 110.883 -178.383 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.449 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 34.9 Cg_exo -52.06 -37.39 68.35 Favored 'Trans proline' 0 C--N 1.309 -1.543 0 CA-C-N 118.571 1.185 . . . . 0.31 112.635 179.59 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . 0.464 ' HB1' ' HB3' ' A' ' 28' ' ' SER . . . -77.38 -51.45 10.79 Favored 'General case' 0 N--CA 1.492 1.628 0 O-C-N 121.304 -0.873 . . . . 0.24 109.831 -179.808 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 50.9 tttp -60.07 -35.44 75.16 Favored 'General case' 0 N--CA 1.494 1.76 0 O-C-N 121.216 -0.928 . . . . 1.59 109.706 179.678 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.499 ' SD ' ' O ' ' A' ' 37' ' ' MET . 1.4 tmt? -59.39 -27.74 66.27 Favored 'General case' 0 N--CA 1.492 1.667 0 O-C-N 121.502 -0.749 . . . . 2.1 109.789 -179.726 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.564 HG22 ' O ' ' A' ' 38' ' ' ILE . 59.9 mt -87.86 -0.84 7.87 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.793 0 O-C-N 121.644 -0.66 . . . . 0.49 111.157 -178.786 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.583 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 1.5 ptmt -64.84 -31.36 5.4 Favored Pre-proline 0 N--CA 1.494 1.763 0 O-C-N 120.299 -1.501 . . . . 0.8 112.904 -178.69 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.583 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 35.6 Cg_exo -56.42 -39.4 91.55 Favored 'Trans proline' 0 N--CA 1.493 1.493 0 CA-C-N 121.026 1.402 . . . . 0.28 113.277 -177.767 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 52.1 m-85 -67.99 -47.23 69.12 Favored 'General case' 0 C--N 1.303 -1.423 0 C-N-CA 118.279 -1.369 . . . . 0.37 108.292 179.929 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 90.7 t80 -60.14 -53.0 62.95 Favored 'General case' 0 C--N 1.298 -1.634 0 CA-C-O 121.778 0.799 . . . . 0.16 110.155 178.805 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 39.3 t60 -68.63 -40.3 80.38 Favored 'General case' 0 N--CA 1.491 1.596 0 O-C-N 121.72 -0.613 . . . . 0.32 111.188 -179.42 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.422 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 67.1 m -62.62 -40.02 95.67 Favored 'General case' 0 N--CA 1.497 1.925 0 O-C-N 120.958 -1.089 . . . . 0.22 110.769 -179.45 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 30.9 mt -63.12 -20.87 65.77 Favored 'General case' 0 N--CA 1.494 1.734 0 O-C-N 121.307 -0.871 . . . . 0.22 110.371 -178.493 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 52.8 m -52.08 -39.82 60.27 Favored 'General case' 0 N--CA 1.488 1.425 0 O-C-N 120.759 -1.213 . . . . 0.16 108.718 -178.982 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 77.8 mm-40 -82.74 -17.83 42.9 Favored 'General case' 0 C--N 1.301 -1.536 0 O-C-N 121.231 -0.918 . . . . 2.16 109.596 179.246 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 88.1 tttt -76.81 -35.99 57.23 Favored 'General case' 0 N--CA 1.497 1.917 0 O-C-N 120.675 -1.266 . . . . 1.78 107.816 179.935 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 88.9 m-85 -123.37 67.98 1.0 Allowed 'General case' 0 N--CA 1.496 1.831 0 N-CA-C 106.564 -1.643 . . . . 0.25 106.564 177.445 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.2 p -63.19 -10.44 15.33 Favored 'General case' 0 C--N 1.305 -1.356 0 N-CA-C 108.934 -0.765 . . . . 0.22 108.934 -179.265 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 33.6 t30 -89.83 8.25 32.95 Favored 'General case' 0 N--CA 1.49 1.531 0 N-CA-C 108.869 -0.789 . . . . 1.13 108.869 179.481 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . . . . . . . . . 37.7 t -126.64 147.26 31.53 Favored 'Isoleucine or valine' 0 N--CA 1.492 1.671 0 N-CA-C 107.539 -1.282 . . . . 0.24 107.539 178.617 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . . . . . . . . . 27.1 mm -100.27 123.45 53.16 Favored 'Isoleucine or valine' 0 N--CA 1.499 2.004 0 O-C-N 121.015 -1.053 . . . . 0.15 109.342 -178.658 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.539 ' C ' HD12 ' A' ' 55' ' ' LEU . 59.3 m-85 -106.09 123.96 48.83 Favored 'General case' 0 N--CA 1.506 2.334 0 O-C-N 121.136 -0.977 . . . . 0.12 109.689 179.569 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.539 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.6 mp -110.0 140.16 44.31 Favored 'General case' 0 N--CA 1.506 2.361 0 O-C-N 121.077 -1.014 . . . . 0.22 109.652 178.936 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 -109.93 131.45 55.05 Favored 'General case' 0 N--CA 1.488 1.472 0 N-CA-C 106.942 -1.503 . . . . 1.13 106.942 178.136 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 46.3 t -127.79 135.25 63.53 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.084 0 O-C-N 121.428 -0.795 . . . . 0.15 110.576 -177.992 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . 0.639 ' O ' ' HB3' ' A' ' 62' ' ' ALA . 53.8 t0 -97.49 119.71 36.53 Favored 'General case' 0 N--CA 1.491 1.584 0 N-CA-C 108.19 -1.041 . . . . 1.05 108.19 179.186 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 32.9 m -68.38 -18.47 23.38 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.553 0 O-C-N 120.635 -1.291 . . . . 0.16 108.672 179.693 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.527 ' OD1' ' NE1' ' A' ' 31' ' ' TRP . 1.5 m-20 -92.3 -40.76 10.76 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 121.384 -0.823 . . . . 1.08 111.505 -178.764 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 65.8 m-20 -96.28 -13.69 23.18 Favored 'General case' 0 N--CA 1.503 2.201 0 O-C-N 120.717 -1.24 . . . . 1.07 108.106 179.516 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . 0.639 ' HB3' ' O ' ' A' ' 58' ' ' ASP . . . -125.59 37.83 4.29 Favored 'General case' 0 N--CA 1.489 1.504 0 N-CA-C 107.426 -1.324 . . . . 0.14 107.426 179.164 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 25.0 pt20 -59.7 -23.67 63.32 Favored 'General case' 0 C--N 1.298 -1.665 0 N-CA-C 108.812 -0.81 . . . . 1.47 108.812 -178.757 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.469 ' OD1' ' N ' ' A' ' 65' ' ' VAL . 2.2 p30 -66.35 -36.68 83.51 Favored 'General case' 0 C--N 1.306 -1.325 0 O-C-N 120.979 -1.076 . . . . 1.05 108.757 178.811 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.469 ' N ' ' OD1' ' A' ' 64' ' ' ASP . 4.5 t -71.18 -46.88 63.81 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.594 0 CA-C-O 121.619 0.723 . . . . 0.35 109.88 179.873 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -72.48 -37.14 68.54 Favored 'General case' 0 N--CA 1.49 1.566 0 O-C-N 121.668 -0.645 . . . . 0.26 110.597 -178.643 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 89.0 p -60.09 -37.43 79.94 Favored 'General case' 0 N--CA 1.49 1.527 0 O-C-N 121.154 -0.967 . . . . 0.24 109.466 -179.293 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . . . . . . . . . 36.6 tp10 -66.28 -33.92 76.83 Favored 'General case' 0 C--N 1.302 -1.472 0 O-C-N 121.401 -0.812 . . . . 2.06 109.099 179.163 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . 0.496 ' HB1' HE22 ' A' ' 78' ' ' GLN . . . -85.92 0.45 53.13 Favored 'General case' 0 N--CA 1.493 1.678 0 O-C-N 121.504 -0.747 . . . . 0.23 110.402 -179.34 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 44.7 mp0 53.14 50.05 18.63 Favored 'General case' 0 N--CA 1.494 1.746 0 O-C-N 121.15 -0.969 . . . . 2.02 110.379 179.961 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 23.4 t -67.99 134.41 30.21 Favored 'Isoleucine or valine' 0 C--N 1.301 -1.54 0 O-C-N 120.59 -1.319 . . . . 0.16 108.74 -179.897 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 66.0 mmtt -105.21 -12.94 15.87 Favored 'General case' 0 N--CA 1.491 1.59 0 O-C-N 121.548 -0.72 . . . . 1.6 109.844 -179.609 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.511 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.96 158.22 19.42 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.925 -1.11 . . . . 0.14 110.584 -179.966 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . 0.411 HG23 ' NE1' ' B' ' 67' ' ' TRP . 36.9 p -129.94 155.29 80.82 Favored Pre-proline 0 N--CA 1.502 2.169 0 N-CA-C 108.494 -0.928 . . . . 0.15 108.494 179.248 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 28.4 Cg_endo -75.14 140.15 65.57 Favored 'Cis proline' 0 N--CA 1.497 1.734 0 C-N-CA 123.871 -1.304 . . . . 0.16 113.157 -2.112 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.511 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 90.0 m -125.39 130.34 51.69 Favored 'General case' 0 N--CA 1.495 1.817 0 N-CA-C 108.263 -1.014 . . . . 0.13 108.263 178.163 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . 0.45 ' O ' ' OE1' ' A' ' 88' ' ' GLU . 91.9 m-85 -109.16 131.16 55.33 Favored 'General case' 0 C--N 1.297 -1.69 0 N-CA-C 108.669 -0.863 . . . . 0.2 108.669 -179.529 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . 0.496 HE22 ' HB1' ' A' ' 69' ' ' ALA . 73.0 mt-30 -123.0 141.91 51.43 Favored 'General case' 0 N--CA 1.498 1.972 0 O-C-N 121.347 -0.845 . . . . 0.29 108.743 179.764 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . 0.439 ' CE2' HG22 ' A' ' 24' ' ' VAL . 71.8 m-85 -108.1 135.12 49.99 Favored 'General case' 0 N--CA 1.494 1.734 0 CA-C-O 121.558 0.694 . . . . 0.14 110.741 -179.001 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 82.6 m-85 -129.87 143.57 50.87 Favored 'General case' 0 N--CA 1.487 1.415 0 N-CA-C 109.125 -0.695 . . . . 0.15 109.125 179.253 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 77.4 tttt -147.19 130.98 17.0 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 107.167 -1.42 . . . . 1.68 107.167 179.549 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 70.5 mttt 58.83 26.1 14.39 Favored 'General case' 0 N--CA 1.499 2.001 0 N-CA-C 108.697 -0.853 . . . . 1.22 108.697 -178.403 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 77.15 22.13 71.83 Favored Glycine 0 N--CA 1.488 2.121 0 N-CA-C 109.949 -1.26 . . . . 0.23 109.949 -179.934 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 28.5 mt-30 -129.71 141.52 50.88 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.356 -1.085 . . . . 2.07 110.406 -179.845 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -79.39 125.47 29.56 Favored 'General case' 0 N--CA 1.494 1.726 0 O-C-N 121.271 -0.893 . . . . 1.82 109.466 179.664 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 12.4 m -123.66 11.24 5.11 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.948 0 O-C-N 121.763 -0.586 . . . . 0.3 110.296 179.972 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . 179.51 157.98 20.87 Favored Glycine 0 N--CA 1.497 2.701 0 C-N-CA 118.602 -1.761 . . . . 0.17 111.523 179.819 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . 0.472 ' OE1' ' N ' ' A' ' 89' ' ' PHE . 2.1 tp10 -167.23 148.64 5.75 Favored 'General case' 0 N--CA 1.496 1.873 0 O-C-N 121.775 -0.838 . . . . 1.93 109.146 179.578 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.472 ' N ' ' OE1' ' A' ' 88' ' ' GLU . 4.5 p90 -169.28 156.93 7.23 Favored 'General case' 0 N--CA 1.495 1.823 0 O-C-N 121.504 -0.748 . . . . 0.14 109.936 178.108 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 80.3 p -126.48 163.63 22.92 Favored 'General case' 0 N--CA 1.502 2.13 0 O-C-N 121.484 -0.76 . . . . 0.12 109.646 -179.588 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.481 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 119.85 142.48 6.69 Favored Glycine 0 N--CA 1.495 2.633 0 N-CA-C 109.324 -1.511 . . . . 0.12 109.324 179.836 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . 0.459 ' HB1' ' CD1' ' A' ' 38' ' ' ILE . . . -77.68 65.67 3.22 Favored 'General case' 0 C--N 1.303 -1.45 0 O-C-N 121.316 -1.108 . . . . 0.18 110.1 -179.542 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.04 96.03 5.06 Favored 'General case' 0 N--CA 1.502 2.165 0 N-CA-C 108.367 -0.975 . . . . 0.88 108.367 178.653 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.49 -32.34 72.25 Favored 'General case' 0 N--CA 1.491 1.613 0 O-C-N 121.153 -0.967 . . . . 1.06 111.373 -179.287 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 76.6 mm-40 -65.36 -30.05 70.84 Favored 'General case' 0 N--CA 1.49 1.551 0 O-C-N 120.829 -1.17 . . . . 1.61 109.765 -179.566 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 77.1 tttt -60.42 -34.19 73.59 Favored 'General case' 0 C--N 1.296 -1.722 0 N-CA-C 109.07 -0.715 . . . . 1.45 109.07 -179.035 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.91 -39.38 85.2 Favored 'General case' 0 C--N 1.3 -1.573 0 CA-C-O 122.158 0.98 . . . . 0.19 108.571 179.226 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 13.9 tm-20 -60.68 -44.02 97.0 Favored 'General case' 0 C--N 1.293 -1.879 0 C-N-CA 120.174 -0.61 . . . . 2.1 110.826 -178.324 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.62 -44.02 71.53 Favored 'General case' 0 N--CA 1.493 1.693 0 O-C-N 121.103 -0.998 . . . . 0.19 111.603 -178.203 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 25.0 m -64.0 -39.92 95.19 Favored 'General case' 0 C--N 1.3 -1.545 0 O-C-N 120.853 -1.154 . . . . 0.2 109.683 -178.864 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 63.3 mt -61.84 -49.48 84.05 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.785 0 N-CA-C 108.077 -1.083 . . . . 0.16 108.077 178.876 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.519 ' O ' HG12 ' A' ' 105' ' ' VAL . 19.2 t-20 -60.18 -35.23 74.9 Favored 'General case' 0 C--N 1.301 -1.542 0 N-CA-C 108.257 -1.016 . . . . 0.95 108.257 179.166 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 36.8 tp10 -68.0 -40.07 83.09 Favored 'General case' 0 C--N 1.3 -1.568 0 O-C-N 121.436 -0.79 . . . . 2.21 110.616 -179.188 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.683 ' HB2' HD11 ' A' ' 22' ' ' LEU . 90.4 mt -98.78 -3.44 35.61 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 121.232 -0.917 . . . . 0.25 111.185 -178.533 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.519 HG12 ' O ' ' A' ' 102' ' ' ASN . 8.5 p . . . . . 0 N--CA 1.494 1.738 0 O-C-N 120.589 -1.319 . . . . 1.08 109.105 -179.758 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 33.1 Cg_exo . . . . . 0 N--CA 1.495 1.616 0 CA-C-O 120.983 0.326 . . . . 1.46 112.383 . . . . . . . . . 0 0 . 1 . 034 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -80.05 129.85 34.8 Favored 'General case' 0 N--CA 1.49 1.557 0 O-C-N 121.074 -1.016 . . . . 0.88 108.705 179.268 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . . . . . . . . . 24.1 m -98.07 120.12 37.92 Favored 'General case' 0 N--CA 1.497 1.884 0 O-C-N 121.173 -0.955 . . . . 0.7 109.833 -179.376 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 86.1 mt -71.87 -24.16 61.63 Favored 'General case' 0 N--CA 1.494 1.751 0 O-C-N 121.415 -0.803 . . . . 0.61 109.863 179.36 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . . . . . . . . . 71.2 mmtt -66.6 -17.71 64.97 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.314 -0.866 . . . . 1.31 109.692 -178.532 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.481 HD11 ' HA2' ' A' ' 91' ' ' GLY . 29.8 mm -130.02 142.01 44.91 Favored 'Isoleucine or valine' 0 N--CA 1.508 2.444 0 O-C-N 121.677 -0.639 . . . . 0.15 109.856 -179.208 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 58.5 m -101.27 129.28 47.21 Favored 'General case' 0 N--CA 1.502 2.175 0 N-CA-C 107.538 -1.282 . . . . 0.19 107.538 177.961 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . . . . . . . . . 58.5 m -78.72 140.61 38.29 Favored 'General case' 0 N--CA 1.499 2.004 0 O-C-N 120.851 -1.156 . . . . 0.2 110.644 -178.897 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.448 ' C ' ' N ' ' B' ' 69' ' ' VAL . 18.5 m95 -76.15 -10.11 59.16 Favored 'General case' 0 N--CA 1.5 2.032 0 O-C-N 120.801 -1.187 . . . . 0.21 109.566 178.972 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.8 m120 -51.85 -13.7 0.3 Allowed 'General case' 0 C--N 1.303 -1.453 0 O-C-N 121.184 -0.947 . . . . 0.49 108.558 -179.683 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.448 ' N ' ' C ' ' B' ' 67' ' ' TRP . 14.0 m -60.49 145.97 11.54 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.486 0 N-CA-C 108.744 -0.835 . . . . 1.04 108.744 179.093 . . . . . . . . 2 2 . 1 . 034 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 61.9 m-20 -60.04 -37.73 80.65 Favored 'General case' 0 N--CA 1.493 1.705 0 O-C-N 121.042 -1.036 . . . . 1.36 109.532 -179.674 . . . . . . . . 1 1 . 1 . 034 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.49 2.237 0 N-CA-C 109.311 -1.516 . . . . 2.32 109.311 -179.594 . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 39.0 mmt . . . . . 0 N--CA 1.491 1.576 0 CA-C-O 121.359 0.6 . . . . 2.88 109.693 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' A' A ' 2' ' ' VAL . . . . . . . . . . . . . 53.1 t -120.21 155.54 23.24 Favored 'Isoleucine or valine' 0 N--CA 1.504 2.229 0 N-CA-C 109.206 -0.665 . . . . 0.45 109.206 179.935 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 3' ' ' LYS . . . . . . . . . . . . . 22.3 tptp -130.06 128.87 42.82 Favored 'General case' 0 N--CA 1.496 1.86 0 N-CA-C 108.524 -0.917 . . . . 1.67 108.524 -179.943 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 4' ' ' GLN . . . . . . . . . . . . . 64.6 tt0 -97.66 124.33 41.92 Favored 'General case' 0 N--CA 1.496 1.843 0 O-C-N 121.177 -0.952 . . . . 0.31 108.699 179.679 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 28.4 mm -103.27 113.81 41.12 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.57 0 N-CA-C 108.787 -0.82 . . . . 0.19 108.787 179.426 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.417 ' N ' ' OE1' ' A' ' 6' ' ' GLU . 57.3 mp0 -96.09 -1.05 49.44 Favored 'General case' 0 N--CA 1.49 1.529 0 O-C-N 121.112 -0.993 . . . . 2.25 110.092 -179.463 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 7' ' ' SER . . . . . . . . . . . . . 79.5 p -155.49 156.66 35.63 Favored 'General case' 0 N--CA 1.498 1.957 0 O-C-N 120.885 -1.135 . . . . 0.15 111.376 -179.816 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 8' ' ' LYS . . . . . 0.725 ' HZ1' ' HB2' ' A' ' 68' ' ' GLU . 14.5 ttmm -64.08 -31.96 73.35 Favored 'General case' 0 N--CA 1.487 1.4 0 N-CA-C 108.456 -0.942 . . . . 1.65 108.456 178.658 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 9' ' ' THR . . . . . . . . . . . . . 85.0 m -56.72 -49.07 76.27 Favored 'General case' 0 C--N 1.304 -1.372 0 C-N-CA 119.276 -0.97 . . . . 0.23 108.559 -179.478 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 10' ' ' ALA . . . . . . . . . . . . . . . -69.16 -30.72 69.01 Favored 'General case' 0 C--N 1.301 -1.525 0 O-C-N 121.48 -0.763 . . . . 0.17 109.21 178.782 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 11' ' ' PHE . . . . . 0.491 ' CE2' HD11 ' A' ' 15' ' ' LEU . 47.5 t80 -59.67 -42.53 93.09 Favored 'General case' 0 N--CA 1.492 1.64 0 O-C-N 121.301 -0.874 . . . . 0.14 108.875 -179.354 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 12' ' ' GLN . . . . . . . . . . . . . 92.7 mm-40 -65.77 -42.5 90.77 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 108.31 -0.996 . . . . 1.31 108.31 179.533 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 13' ' ' GLU . . . . . . . . . . . . . 81.4 mm-40 -64.27 -37.33 87.09 Favored 'General case' 0 N--CA 1.488 1.425 0 CA-C-O 121.285 0.564 . . . . 1.77 110.173 179.497 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 14' ' ' ALA . . . . . . . . . . . . . . . -67.98 -43.95 77.75 Favored 'General case' 0 C--N 1.302 -1.492 0 O-C-N 121.266 -0.896 . . . . 0.15 108.986 -179.477 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 15' ' ' LEU . . . . . 0.491 HD11 ' CE2' ' A' ' 11' ' ' PHE . 54.6 mt -60.72 -40.79 93.66 Favored 'General case' 0 C--N 1.303 -1.432 0 C-N-CA 119.516 -0.873 . . . . 0.17 108.668 179.908 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 12.2 t70 -68.66 -38.1 80.15 Favored 'General case' 0 N--CA 1.489 1.493 0 O-C-N 121.46 -0.775 . . . . 1.07 110.238 179.573 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 17' ' ' ALA . . . . . . . . . . . . . . . -66.81 -37.31 84.27 Favored 'General case' 0 N--CA 1.494 1.752 0 O-C-N 121.347 -0.845 . . . . 0.18 110.201 -178.694 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.82 -31.83 73.24 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 121.026 -1.046 . . . . 0.17 109.385 179.893 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 19' ' ' GLY . . . . . . . . . . . . . . . 67.3 -124.48 22.48 Favored Glycine 0 N--CA 1.489 2.199 0 N-CA-C 109.897 -1.281 . . . . 0.2 109.897 -179.6 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 20' ' ' ASP . . . . . . . . . . . . . 72.1 m-20 -91.24 4.48 52.2 Favored 'General case' 0 N--CA 1.493 1.72 0 O-C-N 121.398 -1.06 . . . . 1.07 110.149 -179.206 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 21' ' ' LYS . . . . . . . . . . . . . 41.0 mtpt -75.79 147.74 38.98 Favored 'General case' 0 N--CA 1.492 1.656 0 O-C-N 120.973 -1.079 . . . . 1.5 108.848 -179.673 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.716 HD23 ' H ' ' A' ' 23' ' ' VAL . 0.5 OUTLIER -58.51 159.56 6.3 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 107.387 -1.338 . . . . 0.47 107.387 -179.392 . . . . . . . . 3 3 . 1 . 035 nuclear nobuild full ' A' A ' 23' ' ' VAL . . . . . 0.716 ' H ' HD23 ' A' ' 22' ' ' LEU . 67.1 t -148.48 118.18 1.18 Allowed 'Isoleucine or valine' 0 C--N 1.302 -1.47 0 O-C-N 120.964 -1.085 . . . . 0.17 108.097 179.578 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 33.8 t -106.48 142.73 18.7 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.791 0 N-CA-C 107.912 -1.144 . . . . 0.14 107.912 179.824 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 25' ' ' VAL . . . . . . . . . . . . . 41.0 t -125.92 122.46 61.97 Favored 'Isoleucine or valine' 0 N--CA 1.501 2.093 0 O-C-N 121.414 -0.804 . . . . 0.13 109.82 -178.76 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 26' ' ' ASP . . . . . . . . . . . . . 32.0 t0 -99.09 118.85 36.77 Favored 'General case' 0 N--CA 1.498 1.974 0 O-C-N 121.303 -0.873 . . . . 1.05 109.456 179.455 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 47.9 m-85 -94.79 20.49 8.66 Favored 'General case' 0 N--CA 1.503 2.212 0 O-C-N 121.155 -0.966 . . . . 0.73 109.285 179.218 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 28' ' ' SER . . . . . . . . . . . . . 54.0 m -55.94 147.87 18.56 Favored 'General case' 0 C--N 1.29 -1.979 0 O-C-N 120.974 -1.079 . . . . 0.3 110.276 -178.623 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.713 ' HB1' ' NE1' ' A' ' 31' ' ' TRP . . . -84.51 126.03 32.93 Favored 'General case' 0 C--N 1.3 -1.578 0 N-CA-C 107.398 -1.334 . . . . 0.22 107.398 178.61 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 30' ' ' THR . . . . . . . . . . . . . 8.3 t -69.07 -32.02 71.17 Favored 'General case' 0 C--N 1.298 -1.641 0 C-N-CA 118.661 -1.215 . . . . 0.3 107.829 179.395 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 31' ' ' TRP . . . . . 0.713 ' NE1' ' HB1' ' A' ' 29' ' ' ALA . 62.8 p-90 -70.42 -22.42 62.72 Favored 'General case' 0 N--CA 1.49 1.542 0 O-C-N 121.69 -0.631 . . . . 0.26 110.98 179.81 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 32' ' ' CYS . . . . . . . . . . . . . 10.2 t -84.74 115.33 22.64 Favored 'General case' 0 N--CA 1.491 1.601 0 O-C-N 120.788 -1.195 . . . . 0.26 108.239 -179.772 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 33' ' ' GLY . . . . . 0.445 ' N ' ' CD ' ' A' ' 34' ' ' PRO . . . -61.29 -51.89 55.16 Favored Glycine 0 N--CA 1.488 2.15 0 C-N-CA 120.437 -0.887 . . . . 0.23 111.391 -178.397 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.445 ' CD ' ' N ' ' A' ' 33' ' ' GLY . 35.2 Cg_exo -51.81 -35.45 59.06 Favored 'Trans proline' 0 C--N 1.31 -1.485 0 CA-C-N 118.809 1.305 . . . . 0.31 111.325 -179.726 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 35' ' ' ALA . . . . . . . . . . . . . . . -76.98 -50.29 13.51 Favored 'General case' 0 N--CA 1.488 1.47 0 O-C-N 121.531 -0.731 . . . . 0.24 110.09 -179.747 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 52.2 tttp -59.81 -34.95 73.73 Favored 'General case' 0 N--CA 1.489 1.521 0 O-C-N 121.086 -1.009 . . . . 1.59 109.026 -179.765 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 37' ' ' MET . . . . . 0.54 ' SD ' ' O ' ' A' ' 37' ' ' MET . 10.1 tmm? -59.23 -27.78 66.08 Favored 'General case' 0 C--N 1.297 -1.678 0 O-C-N 121.403 -0.81 . . . . 2.1 109.313 179.917 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . 0.571 HG22 ' O ' ' A' ' 38' ' ' ILE . 74.9 mt -84.95 -1.99 7.09 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.965 0 O-C-N 121.588 -0.695 . . . . 0.49 111.603 -178.938 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 39' ' ' LYS . . . . . 0.574 ' N ' ' CD ' ' A' ' 40' ' ' PRO . 18.2 pttt -65.44 -30.11 3.82 Favored Pre-proline 0 N--CA 1.493 1.702 0 O-C-N 120.168 -1.582 . . . . 0.8 113.26 -178.627 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 40' ' ' PRO . . . . . 0.574 ' CD ' ' N ' ' A' ' 39' ' ' LYS . 36.2 Cg_exo -55.08 -40.06 87.76 Favored 'Trans proline' 0 N--CA 1.489 1.254 0 CA-C-N 121.403 1.537 . . . . 0.28 112.533 -177.067 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 41' ' ' PHE . . . . . . . . . . . . . 58.9 m-85 -68.26 -45.04 74.24 Favored 'General case' 0 C--N 1.304 -1.386 0 C-N-CA 118.367 -1.333 . . . . 0.37 108.35 179.655 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 42' ' ' PHE . . . . . . . . . . . . . 88.4 t80 -62.13 -51.63 67.08 Favored 'General case' 0 C--N 1.299 -1.617 0 O-C-N 121.21 -0.931 . . . . 0.16 109.697 179.36 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 43' ' ' HIS . . . . . . . . . . . . . 36.5 t60 -67.33 -41.84 84.59 Favored 'General case' 0 N--CA 1.493 1.713 0 CA-C-O 121.524 0.678 . . . . 0.32 110.741 179.841 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.426 ' CB ' ' O ' ' A' ' 40' ' ' PRO . 68.3 m -62.22 -39.94 94.44 Favored 'General case' 0 C--N 1.299 -1.603 0 O-C-N 121.273 -0.892 . . . . 0.22 110.195 -179.287 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 33.9 mt -60.74 -23.14 64.72 Favored 'General case' 0 N--CA 1.494 1.77 0 O-C-N 121.344 -0.848 . . . . 0.22 110.613 -179.023 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 46' ' ' SER . . . . . . . . . . . . . 55.2 m -53.36 -35.38 60.2 Favored 'General case' 0 C--N 1.299 -1.593 0 O-C-N 120.801 -1.187 . . . . 0.16 108.849 -179.254 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.534 ' OE1' ' N ' ' A' ' 47' ' ' GLU . 48.3 mp0 -88.88 -13.38 39.31 Favored 'General case' 0 C--N 1.302 -1.491 0 O-C-N 121.195 -0.941 . . . . 2.16 108.959 179.198 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 21.3 tptm -77.77 -39.97 42.37 Favored 'General case' 0 N--CA 1.495 1.777 0 N-CA-C 107.814 -1.18 . . . . 1.78 107.814 178.698 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -123.87 69.6 1.06 Allowed 'General case' 0 N--CA 1.495 1.808 0 N-CA-C 106.741 -1.577 . . . . 0.25 106.741 178.058 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 50' ' ' SER . . . . . . . . . . . . . 78.7 p -63.35 -9.07 10.41 Favored 'General case' 0 C--N 1.3 -1.553 0 N-CA-C 108.543 -0.91 . . . . 0.22 108.543 -179.32 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 15.3 t30 -89.68 8.03 33.66 Favored 'General case' 0 N--CA 1.487 1.41 0 N-CA-C 108.202 -1.036 . . . . 1.13 108.202 179.146 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 52' ' ' VAL . . . . . 0.47 HG13 ' HB3' ' A' ' 22' ' ' LEU . 56.0 t -126.45 142.74 42.16 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.425 0 N-CA-C 107.996 -1.113 . . . . 0.24 107.996 179.114 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 53' ' ' ILE . . . . . 0.427 HG22 ' CD1' ' A' ' 55' ' ' LEU . 30.7 mm -97.88 121.31 48.27 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.928 0 O-C-N 121.217 -0.927 . . . . 0.15 109.65 -178.995 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 54' ' ' PHE . . . . . 0.524 ' C ' HD12 ' A' ' 55' ' ' LEU . 43.6 m-85 -101.63 125.4 48.28 Favored 'General case' 0 N--CA 1.505 2.294 0 O-C-N 121.391 -0.818 . . . . 0.12 109.385 179.551 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.524 HD12 ' C ' ' A' ' 54' ' ' PHE . 5.9 mp -110.28 144.85 38.37 Favored 'General case' 0 N--CA 1.508 2.462 0 O-C-N 121.075 -1.016 . . . . 0.22 110.097 179.14 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 82.3 tt0 -112.52 131.51 55.56 Favored 'General case' 0 N--CA 1.49 1.529 0 N-CA-C 107.216 -1.402 . . . . 1.13 107.216 177.825 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 57' ' ' VAL . . . . . . . . . . . . . 86.1 t -128.21 132.08 68.67 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.945 0 O-C-N 121.404 -0.81 . . . . 0.15 109.744 -178.849 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 58' ' ' ASP . . . . . . . . . . . . . 52.9 t0 -95.11 120.0 34.57 Favored 'General case' 0 N--CA 1.492 1.654 0 N-CA-C 108.872 -0.788 . . . . 1.05 108.872 179.873 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 59' ' ' VAL . . . . . . . . . . . . . 35.4 m -64.99 -19.84 26.43 Favored 'Isoleucine or valine' 0 C--N 1.294 -1.813 0 O-C-N 120.378 -1.451 . . . . 0.16 107.876 179.199 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 60' ' ' ASP . . . . . 0.499 ' OD2' ' CD1' ' A' ' 31' ' ' TRP . 28.5 m-20 -92.64 -41.67 10.06 Favored 'General case' 0 N--CA 1.496 1.85 0 O-C-N 121.457 -0.777 . . . . 1.08 112.403 -178.746 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 61' ' ' ASP . . . . . . . . . . . . . 35.7 m-20 -95.67 -18.23 20.67 Favored 'General case' 0 N--CA 1.504 2.273 0 O-C-N 120.36 -1.463 . . . . 1.07 108.99 -179.576 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 62' ' ' ALA . . . . . . . . . . . . . . . -123.82 40.7 3.66 Favored 'General case' 0 N--CA 1.493 1.692 0 N-CA-C 107.735 -1.209 . . . . 0.14 107.735 179.029 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 63' ' ' GLN . . . . . . . . . . . . . 16.8 pt20 -60.18 -19.13 52.63 Favored 'General case' 0 N--CA 1.487 1.423 0 N-CA-C 109.469 -0.567 . . . . 1.47 109.469 -179.161 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 64' ' ' ASP . . . . . 0.59 ' OD1' HG23 ' A' ' 65' ' ' VAL . 1.5 p30 -62.22 -39.43 92.76 Favored 'General case' 0 C--N 1.303 -1.432 0 O-C-N 120.985 -1.072 . . . . 1.05 108.849 179.87 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 65' ' ' VAL . . . . . 0.59 HG23 ' OD1' ' A' ' 64' ' ' ASP . 21.2 t -73.69 -43.98 53.35 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.438 0 O-C-N 121.274 -0.891 . . . . 0.35 109.849 -179.973 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 66' ' ' ALA . . . . . . . . . . . . . . . -68.37 -40.57 81.39 Favored 'General case' 0 C--N 1.302 -1.475 0 O-C-N 121.396 -0.815 . . . . 0.26 110.471 -178.273 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 67' ' ' SER . . . . . . . . . . . . . 87.6 p -60.32 -39.29 86.51 Favored 'General case' 0 N--CA 1.489 1.524 0 O-C-N 121.048 -1.032 . . . . 0.24 109.177 -179.798 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 68' ' ' GLU . . . . . 0.725 ' HB2' ' HZ1' ' A' ' 8' ' ' LYS . 40.4 tt0 -62.97 -38.99 93.34 Favored 'General case' 0 N--CA 1.491 1.615 0 O-C-N 121.337 -0.852 . . . . 2.06 109.832 179.433 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 69' ' ' ALA . . . . . . . . . . . . . . . -86.68 -2.5 58.58 Favored 'General case' 0 N--CA 1.491 1.575 0 O-C-N 121.437 -0.789 . . . . 0.23 111.179 -178.416 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 70' ' ' GLU . . . . . . . . . . . . . 80.8 mm-40 56.03 49.15 16.26 Favored 'General case' 0 N--CA 1.496 1.859 0 O-C-N 121.163 -0.96 . . . . 2.02 109.947 -179.913 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 71' ' ' VAL . . . . . . . . . . . . . 38.6 t -62.84 132.47 28.67 Favored 'Isoleucine or valine' 0 C--N 1.3 -1.581 0 C-N-CA 118.586 -1.246 . . . . 0.16 108.038 -179.617 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 72' ' ' LYS . . . . . . . . . . . . . 67.7 mmtt -105.26 -12.17 16.19 Favored 'General case' 0 N--CA 1.489 1.499 0 O-C-N 121.478 -0.764 . . . . 1.6 110.173 -179.039 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 73' ' ' ALA . . . . . 0.465 ' O ' ' OG1' ' A' ' 76' ' ' THR . . . -163.86 156.22 17.44 Favored 'General case' 0 N--CA 1.493 1.682 0 O-C-N 120.829 -1.169 . . . . 0.14 111.071 179.749 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 74' ' ' THR . . . . . . . . . . . . . 30.3 p -127.72 156.28 75.89 Favored Pre-proline 0 N--CA 1.496 1.844 0 N-CA-C 107.966 -1.124 . . . . 0.15 107.966 179.087 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 75' ' ' PRO . . . . . . . . . . . . . 25.9 Cg_endo -74.36 143.39 77.68 Favored 'Cis proline' 0 N--CA 1.494 1.547 0 C-N-CA 123.85 -1.312 . . . . 0.16 112.851 -3.682 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 76' ' ' THR . . . . . 0.465 ' OG1' ' O ' ' A' ' 73' ' ' ALA . 94.9 m -128.24 133.7 48.87 Favored 'General case' 0 N--CA 1.497 1.888 0 N-CA-C 108.492 -0.929 . . . . 0.13 108.492 177.926 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 77' ' ' PHE . . . . . . . . . . . . . 92.4 m-85 -111.46 131.69 55.03 Favored 'General case' 0 N--CA 1.493 1.679 0 N-CA-C 108.803 -0.814 . . . . 0.2 108.803 -179.236 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 78' ' ' GLN . . . . . . . . . . . . . 80.3 mt-30 -122.96 140.61 52.83 Favored 'General case' 0 N--CA 1.497 1.914 0 O-C-N 121.183 -0.948 . . . . 0.29 109.161 179.457 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 79' ' ' PHE . . . . . . . . . . . . . 78.1 m-85 -108.28 135.55 49.42 Favored 'General case' 0 N--CA 1.496 1.832 0 CA-C-O 121.309 0.576 . . . . 0.14 110.448 -179.207 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 80' ' ' PHE . . . . . . . . . . . . . 84.7 m-85 -126.32 149.16 49.35 Favored 'General case' 0 N--CA 1.486 1.364 0 CA-C-O 121.43 0.633 . . . . 0.15 109.434 179.341 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 81' ' ' LYS . . . . . . . . . . . . . 23.5 tptp -146.76 126.41 13.37 Favored 'General case' 0 N--CA 1.487 1.403 0 N-CA-C 106.964 -1.495 . . . . 1.68 106.964 -179.734 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 82' ' ' LYS . . . . . . . . . . . . . 46.9 mttp 54.02 34.08 18.98 Favored 'General case' 0 N--CA 1.492 1.658 0 O-C-N 120.938 -1.101 . . . . 1.22 108.677 -177.987 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 83' ' ' GLY . . . . . . . . . . . . . . . 72.64 20.71 79.72 Favored Glycine 0 N--CA 1.488 2.147 0 N-CA-C 110.017 -1.233 . . . . 0.23 110.017 179.568 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 84' ' ' GLN . . . . . . . . . . . . . 2.6 mm100 -124.45 133.5 53.35 Favored 'General case' 0 N--CA 1.502 2.158 0 O-C-N 121.427 -1.043 . . . . 2.07 110.611 -179.766 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 85' ' ' LYS . . . . . . . . . . . . . 39.0 ttmt -78.4 124.06 27.69 Favored 'General case' 0 N--CA 1.496 1.86 0 O-C-N 121.241 -0.912 . . . . 1.82 109.732 179.657 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 86' ' ' VAL . . . . . . . . . . . . . 18.4 m -123.99 10.8 4.95 Favored 'Isoleucine or valine' 0 N--CA 1.498 1.966 0 O-C-N 121.663 -0.648 . . . . 0.3 110.522 -179.578 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 87' ' ' GLY . . . . . . . . . . . . . . . -177.83 151.26 10.6 Favored Glycine 0 N--CA 1.493 2.487 0 C-N-CA 118.564 -1.779 . . . . 0.17 111.451 -179.819 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 88' ' ' GLU . . . . . . . . . . . . . 5.8 tm-20 -164.92 148.01 8.48 Favored 'General case' 0 N--CA 1.486 1.365 0 O-C-N 121.815 -0.815 . . . . 1.93 109.045 179.285 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 89' ' ' PHE . . . . . 0.406 ' CD1' ' C ' ' A' ' 89' ' ' PHE . 11.1 p90 -164.19 159.03 19.72 Favored 'General case' 0 N--CA 1.496 1.865 0 O-C-N 121.198 -0.939 . . . . 0.14 110.025 178.16 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 90' ' ' SER . . . . . . . . . . . . . 79.8 p -126.24 159.98 31.56 Favored 'General case' 0 N--CA 1.497 1.9 0 CA-C-O 121.58 0.705 . . . . 0.12 109.786 -179.529 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 91' ' ' GLY . . . . . 0.474 ' HA2' HD11 ' B' ' 64' ' ' ILE . . . 123.37 143.0 6.21 Favored Glycine 0 N--CA 1.49 2.285 0 N-CA-C 109.241 -1.544 . . . . 0.12 109.241 179.099 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 92' ' ' ALA . . . . . . . . . . . . . . . -76.39 66.58 2.47 Favored 'General case' 0 C--N 1.3 -1.574 0 O-C-N 121.258 -1.142 . . . . 0.18 109.606 -179.879 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 93' ' ' ASN . . . . . . . . . . . . . 0.7 OUTLIER -119.84 92.51 3.8 Favored 'General case' 0 N--CA 1.499 1.982 0 N-CA-C 108.175 -1.046 . . . . 0.88 108.175 178.909 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 94' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -67.97 -32.53 73.02 Favored 'General case' 0 N--CA 1.49 1.546 0 O-C-N 121.445 -0.784 . . . . 1.06 111.196 -179.093 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 95' ' ' GLU . . . . . . . . . . . . . 80.7 mm-40 -63.92 -30.8 71.85 Favored 'General case' 0 N--CA 1.49 1.526 0 O-C-N 121.035 -1.041 . . . . 1.61 109.521 -179.619 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 96' ' ' LYS . . . . . . . . . . . . . 76.7 tttt -60.36 -35.33 75.44 Favored 'General case' 0 C--N 1.295 -1.766 0 N-CA-C 109.215 -0.661 . . . . 1.45 109.215 -179.003 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 97' ' ' LEU . . . . . . . . . . . . . 58.7 mt -59.86 -38.88 83.38 Favored 'General case' 0 C--N 1.303 -1.419 0 N-CA-C 108.562 -0.903 . . . . 0.19 108.562 179.106 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 98' ' ' GLU . . . . . . . . . . . . . 85.1 tt0 -61.47 -43.75 98.31 Favored 'General case' 0 C--N 1.298 -1.663 0 C-N-CA 120.261 -0.576 . . . . 2.1 110.673 -178.029 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 99' ' ' ALA . . . . . . . . . . . . . . . -69.88 -43.81 71.07 Favored 'General case' 0 C--N 1.299 -1.597 0 O-C-N 121.211 -0.931 . . . . 0.19 111.543 -178.768 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 100' ' ' THR . . . . . . . . . . . . . 28.1 m -64.17 -39.93 95.05 Favored 'General case' 0 C--N 1.303 -1.437 0 O-C-N 120.868 -1.145 . . . . 0.2 110.18 -178.585 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 101' ' ' ILE . . . . . . . . . . . . . 58.3 mt -61.39 -48.97 86.42 Favored 'Isoleucine or valine' 0 N--CA 1.495 1.804 0 N-CA-C 108.162 -1.051 . . . . 0.16 108.162 179.118 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 102' ' ' ASN . . . . . 0.51 ' O ' HG12 ' A' ' 105' ' ' VAL . 22.1 t-20 -60.63 -34.62 74.55 Favored 'General case' 0 C--N 1.302 -1.471 0 N-CA-C 108.389 -0.967 . . . . 0.95 108.389 179.448 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 103' ' ' GLU . . . . . . . . . . . . . 43.4 tp10 -68.03 -39.93 83.02 Favored 'General case' 0 C--N 1.297 -1.695 0 O-C-N 121.532 -0.73 . . . . 2.21 110.909 -178.587 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' A' A ' 104' ' ' LEU . . . . . 0.505 ' HB2' HD11 ' A' ' 22' ' ' LEU . 88.0 mt -100.17 0.22 40.09 Favored 'General case' 0 N--CA 1.498 1.97 0 O-C-N 121.108 -0.995 . . . . 0.25 111.141 -178.333 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' A' A ' 105' ' ' VAL . . . . . 0.51 HG12 ' O ' ' A' ' 102' ' ' ASN . 9.5 p . . . . . 0 N--CA 1.498 1.938 0 O-C-N 120.683 -1.26 . . . . 1.08 109.464 -179.489 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 59' ' ' PRO . . . . . . . . . . . . . 23.7 Cg_endo . . . . . 0 N--CA 1.495 1.574 0 CA-C-O 121.055 0.356 . . . . 1.46 111.865 . . . . . . . . . 0 0 . 1 . 035 nuclear nobuild full ' B' B ' 60' ' ' ALA . . . . . . . . . . . . . . . -87.45 121.95 30.55 Favored 'General case' 0 N--CA 1.494 1.743 0 O-C-N 120.998 -1.064 . . . . 0.88 108.498 179.658 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 61' ' ' THR . . . . . 0.47 HG22 ' H ' ' B' ' 63' ' ' LYS . 22.7 m -107.44 125.88 51.79 Favored 'General case' 0 N--CA 1.501 2.113 0 O-C-N 121.461 -0.774 . . . . 0.7 109.844 -179.082 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 62' ' ' LEU . . . . . . . . . . . . . 53.4 mt -70.01 -23.6 63.16 Favored 'General case' 0 N--CA 1.492 1.671 0 O-C-N 121.447 -0.783 . . . . 0.61 109.788 179.702 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 63' ' ' LYS . . . . . 0.47 ' H ' HG22 ' B' ' 61' ' ' THR . 65.8 mmtt -60.79 -16.43 40.5 Favored 'General case' 0 C--N 1.299 -1.599 0 O-C-N 121.497 -0.752 . . . . 1.31 109.132 -178.914 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 64' ' ' ILE . . . . . 0.474 HD11 ' HA2' ' A' ' 91' ' ' GLY . 28.9 mm -135.85 142.43 39.13 Favored 'Isoleucine or valine' 0 N--CA 1.509 2.498 0 N-CA-C 109.406 -0.59 . . . . 0.15 109.406 -179.649 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 65' ' ' CYS . . . . . . . . . . . . . 9.4 m -101.71 127.2 48.58 Favored 'General case' 0 N--CA 1.506 2.326 0 N-CA-C 107.543 -1.28 . . . . 0.19 107.543 177.634 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 66' ' ' SER . . . . . 0.431 ' O ' HG23 ' B' ' 69' ' ' VAL . 65.1 m -78.81 139.94 38.29 Favored 'General case' 0 N--CA 1.501 2.077 0 O-C-N 120.865 -1.147 . . . . 0.2 111.562 -178.291 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 67' ' ' TRP . . . . . 0.504 ' O ' ' N ' ' B' ' 69' ' ' VAL . 24.0 m95 -72.94 -8.75 57.08 Favored 'General case' 0 N--CA 1.492 1.653 0 N-CA-C 108.912 -0.773 . . . . 0.21 108.912 178.283 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 68' ' ' ASN . . . . . . . . . . . . . 2.4 m120 -49.94 -10.59 0.05 Allowed 'General case' 0 C--N 1.301 -1.516 0 N-CA-C 108.794 -0.817 . . . . 0.49 108.794 179.37 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 69' ' ' VAL . . . . . 0.504 ' N ' ' O ' ' B' ' 67' ' ' TRP . 4.7 t -42.4 153.22 0.08 OUTLIER 'Isoleucine or valine' 0 N--CA 1.496 1.834 0 O-C-N 121.431 -0.793 . . . . 1.04 110.135 -179.446 . . . . . . . . 2 2 . 1 . 035 nuclear nobuild full ' B' B ' 70' ' ' ASP . . . . . . . . . . . . . 8.6 m-20 -60.25 -39.61 87.34 Favored 'General case' 0 N--CA 1.49 1.57 0 O-C-N 121.201 -0.937 . . . . 1.36 109.086 179.986 . . . . . . . . 1 1 . 1 . 035 nuclear nobuild full ' B' B ' 71' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.489 2.225 0 CA-C-O 118.042 -1.421 . . . . 2.32 109.825 -179.855 . . . . . . . . 0 0 . 1 stop_ save_