data_2lp5_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 2lp5 _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.8 mt . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 108.592 -0.892 . . . . 25.0 108.592 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -130.16 147.97 51.95 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.247 1.019 . . . . 25.0 109.366 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -121.5 152.65 38.93 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.092 1.357 . . . . 25.0 110.705 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.89 135.57 35.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.201 1.4 . . . . 25.0 113.366 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 86.1 mt -98.47 -24.56 15.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.064 1.745 . . . . 25.0 112.242 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.03 153.04 38.43 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.557 1.143 . . . . 25.0 110.527 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.1 149.22 37.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 109.332 -0.618 . . . . 25.0 109.332 175.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -146.61 137.23 23.93 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.719 0.807 . . . . 25.0 109.592 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -112.89 136.87 52.06 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 106.972 -1.492 . . . . 25.0 106.972 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.39 127.92 34.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.261 1.025 . . . . 25.0 110.068 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -93.59 -20.42 20.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.422 1.089 . . . . 25.0 112.338 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.0 p -130.07 171.27 13.0 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.027 1.331 . . . . 25.0 110.119 179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.06 -18.97 64.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.248 1.019 . . . . 25.0 112.366 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -101.96 -2.93 28.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.771 1.628 . . . . 25.0 112.815 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.0 156.06 18.24 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.28 0.945 . . . . 25.0 110.87 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 mt -107.22 140.47 40.04 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.314 1.446 . . . . 25.0 110.787 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.5 m -97.5 145.07 26.58 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.674 1.19 . . . . 25.0 107.834 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -156.82 170.81 21.62 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.714 0.769 . . . . 25.0 111.074 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -122.87 156.81 33.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.337 1.455 . . . . 25.0 108.727 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.21 44.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.702 1.201 . . . . 25.0 110.198 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.45 -9.54 66.93 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.343 1.449 . . . . 25.0 113.38 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.34 133.97 46.38 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.066 1.433 . . . . 25.0 110.19 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -102.05 152.62 20.76 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.69 0.796 . . . . 25.0 110.616 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.3 156.23 48.5 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.292 1.437 . . . . 25.0 112.822 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -107.45 128.98 54.97 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 104.648 -2.353 . . . . 25.0 104.648 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.5 mm -82.07 123.0 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.511 0.725 . . . . 25.0 110.995 -177.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.0 mt -91.45 -44.48 9.09 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.171 -1.048 . . . . 25.0 108.171 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -158.83 127.46 5.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.408 1.083 . . . . 25.0 108.948 178.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.2 p -125.62 12.5 8.01 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.6 p -93.28 5.32 51.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.524 1.13 . . . . 25.0 112.773 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -91.15 12.43 20.05 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.846 1.658 . . . . 25.0 114.711 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.66 -157.81 18.7 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 118.651 0.66 . . . . 25.0 111.529 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -69.47 -1.12 7.7 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.883 1.273 . . . . 25.0 111.717 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -112.15 105.74 14.17 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.52 1.928 . . . . 25.0 106.456 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -105.38 151.08 24.64 Favored 'General case' 0 C--N 1.345 0.385 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -96.02 126.37 41.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.472 -2.048 . . . . 25.0 105.472 177.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.1 m -142.86 168.28 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.933 0.873 . . . . 25.0 112.605 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -121.35 127.62 51.45 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.522 1.929 . . . . 25.0 107.738 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.7 t -76.54 119.66 20.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 106.788 -1.56 . . . . 25.0 106.788 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.4 mt -76.74 -15.9 59.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.334 0.654 . . . . 25.0 111.207 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.6 m -87.59 -46.08 9.86 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.146 1.378 . . . . 25.0 112.265 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.9 p -101.19 -21.05 15.03 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.472 1.286 . . . . 25.0 114.472 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.76 2.34 90.5 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.558 -1.134 . . . . 25.0 112.451 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -84.59 160.94 20.34 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-N 119.005 1.403 . . . . 25.0 110.871 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 37.0 p -121.07 144.28 48.63 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 124.461 1.104 . . . . 25.0 111.202 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.47 -168.46 39.03 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.478 1.037 . . . . 25.0 112.559 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -115.17 143.21 45.58 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 125.183 1.393 . . . . 25.0 111.006 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.3 pt -145.22 154.79 54.35 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 125.278 1.431 . . . . 25.0 109.82 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.43 122.63 9.39 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.911 2.407 . . . . 25.0 111.361 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.0 t -58.86 -36.99 48.69 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-O 116.154 -1.879 . . . . 25.0 115.042 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -63.63 -17.74 61.25 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.539 2.159 . . . . 25.0 114.684 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.64 -3.92 46.37 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.088 0.858 . . . . 25.0 110.343 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.5 mt -118.84 158.44 25.65 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.491 1.516 . . . . 25.0 112.371 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.78 141.88 36.76 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.13 2.172 . . . . 25.0 108.837 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.9 141.64 59.5 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.697 2.265 . . . . 25.0 111.113 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 87.6 t . . . . . 0 CA--C 1.535 0.375 0 C-N-CA 124.675 1.19 . . . . 25.0 108.19 179.154 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 58.0 mt . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.407 -0.59 . . . . 25.0 109.407 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -131.95 157.1 44.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.112 1.365 . . . . 25.0 111.506 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -133.66 152.23 51.84 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.855 1.662 . . . . 25.0 110.142 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.76 133.1 37.13 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.741 1.616 . . . . 25.0 113.112 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.8 mt -94.46 -28.42 15.49 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.419 1.888 . . . . 25.0 112.391 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -146.58 155.22 42.32 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 124.757 1.223 . . . . 25.0 110.436 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -61.19 149.13 38.5 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.842 -0.799 . . . . 25.0 108.842 175.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -147.63 138.64 23.5 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 123.539 0.736 . . . . 25.0 109.996 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -116.97 137.67 52.07 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 107.731 -1.211 . . . . 25.0 107.731 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.3 130.59 46.89 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.309 1.044 . . . . 25.0 111.259 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -90.93 -26.19 19.41 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.48 1.112 . . . . 25.0 111.925 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.0 p -131.14 172.45 12.1 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.317 1.447 . . . . 25.0 110.437 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.64 -18.79 64.35 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.084 0.953 . . . . 25.0 112.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -94.86 -8.15 38.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.562 1.545 . . . . 25.0 112.3 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -94.27 156.67 16.41 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.332 1.053 . . . . 25.0 110.259 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 mt -112.11 141.43 45.79 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.83 1.252 . . . . 25.0 110.143 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.7 p -99.34 146.21 26.51 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.002 1.321 . . . . 25.0 108.126 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.23 175.68 13.13 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.801 0.81 . . . . 25.0 111.059 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -126.88 159.61 33.44 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.151 1.38 . . . . 25.0 108.532 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.19 134.31 44.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.609 1.164 . . . . 25.0 110.292 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.65 -11.27 62.9 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 125.234 1.397 . . . . 25.0 113.489 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -70.4 136.67 49.8 Favored 'General case' 0 C--N 1.347 0.483 0 CA-C-N 119.212 1.506 . . . . 25.0 109.452 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -101.67 150.05 23.51 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.84 0.829 . . . . 25.0 112.049 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -141.47 161.28 38.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.809 2.044 . . . . 25.0 111.295 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -121.51 137.87 54.54 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.459 2.303 . . . . 25.0 105.629 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -86.73 127.66 40.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 122.778 0.431 . . . . 25.0 110.603 -178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.8 mt -97.47 -41.08 8.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.694 1.198 . . . . 25.0 109.85 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.0 130.85 9.15 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.917 0.887 . . . . 25.0 109.962 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.6 p -125.64 12.37 7.99 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.447 1.647 . . . . 25.0 115.447 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.4 p -95.11 0.22 54.08 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.866 1.267 . . . . 25.0 113.225 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -88.84 16.12 7.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.746 1.618 . . . . 25.0 113.433 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.86 -158.18 18.5 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 118.497 0.59 . . . . 25.0 112.869 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.64 -7.72 35.68 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.298 1.439 . . . . 25.0 112.19 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -111.57 123.08 49.5 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 105.691 -1.966 . . . . 25.0 105.691 177.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.29 157.0 21.48 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.221 1.193 . . . . 25.0 114.221 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.85 131.97 41.61 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.58 1.952 . . . . 25.0 106.283 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.9 m -139.19 167.76 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.538 1.161 . . . . 25.0 113.922 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -125.65 114.76 19.12 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.738 2.815 . . . . 25.0 104.919 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.8 t -74.99 121.92 22.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.463 -0.94 . . . . 25.0 108.463 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.73 -21.25 55.55 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.135 0.974 . . . . 25.0 111.418 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.0 m -88.21 -46.01 9.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.616 1.166 . . . . 25.0 112.179 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.1 p -93.89 -21.53 19.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.477 0.917 . . . . 25.0 113.477 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.45 0.62 87.39 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 118.337 -1.257 . . . . 25.0 112.558 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -90.36 166.9 13.03 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.037 1.419 . . . . 25.0 111.789 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 p -122.7 145.47 48.36 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.878 1.271 . . . . 25.0 110.513 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.67 -168.41 38.84 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.579 1.085 . . . . 25.0 112.117 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -116.27 137.32 52.24 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.974 1.31 . . . . 25.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.8 pt -144.92 155.29 55.66 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.915 1.286 . . . . 25.0 110.651 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.08 123.96 10.87 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.981 3.121 . . . . 25.0 112.941 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 p -59.46 -36.23 38.57 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-O 115.852 -2.023 . . . . 25.0 115.955 178.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.98 -18.73 63.0 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 123.322 2.222 . . . . 25.0 114.376 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -79.56 -3.77 48.4 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.906 0.775 . . . . 25.0 110.938 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.0 mt -119.54 158.2 26.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.087 1.355 . . . . 25.0 112.38 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -142.3 141.09 20.19 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 127.452 2.301 . . . . 25.0 107.967 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.23 146.16 89.89 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.581 2.187 . . . . 25.0 112.229 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 125.085 1.354 . . . . 25.0 108.397 179.688 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.7 mt . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.202 0.525 . . . . 25.0 110.15 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -130.34 150.16 51.7 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.907 1.683 . . . . 25.0 107.194 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -127.34 148.07 50.25 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.354 1.062 . . . . 25.0 110.693 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.41 132.49 37.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.192 1.397 . . . . 25.0 112.212 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.9 mt -89.5 -28.74 19.44 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.338 1.855 . . . . 25.0 112.301 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -151.65 158.71 43.82 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.861 1.264 . . . . 25.0 110.618 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -61.19 149.11 38.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.3 0.64 . . . . 25.0 109.863 176.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -147.06 135.11 21.47 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 123.907 0.883 . . . . 25.0 109.878 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -113.57 136.98 52.22 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.02 128.73 38.28 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.554 1.141 . . . . 25.0 111.083 -179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -82.68 -25.83 32.65 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.789 1.236 . . . . 25.0 111.599 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -130.94 168.92 16.53 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.385 1.474 . . . . 25.0 109.98 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.04 -15.83 63.77 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.2 1.0 . . . . 25.0 112.825 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -101.31 -2.64 30.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.778 1.631 . . . . 25.0 113.018 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -94.84 156.79 16.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.562 1.145 . . . . 25.0 110.187 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 mt -97.43 136.24 38.16 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.738 1.215 . . . . 25.0 111.493 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.0 m -98.61 144.02 28.37 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -158.34 173.12 17.15 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.932 0.872 . . . . 25.0 111.438 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -126.43 159.17 34.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.329 1.452 . . . . 25.0 108.572 178.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.17 134.26 44.36 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.75 1.22 . . . . 25.0 110.208 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.33 -10.22 65.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.148 1.356 . . . . 25.0 113.462 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.13 138.07 51.61 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 119.255 1.527 . . . . 25.0 110.057 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -102.63 150.76 23.11 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.409 0.684 . . . . 25.0 111.764 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -138.05 159.49 41.89 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.132 1.373 . . . . 25.0 113.682 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -112.75 125.53 54.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.38 -2.822 . . . . 25.0 103.38 176.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 mm -85.43 122.53 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.398 -0.964 . . . . 25.0 108.398 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.4 mt -90.19 -41.94 11.32 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.051 0.94 . . . . 25.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.57 126.74 5.86 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.841 0.857 . . . . 25.0 109.882 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p -125.69 12.34 7.96 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 114.818 1.414 . . . . 25.0 114.818 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.0 p -93.52 -0.86 56.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.896 1.278 . . . . 25.0 113.364 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -89.58 14.22 12.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.4 1.48 . . . . 25.0 113.761 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.82 -157.88 18.58 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 118.621 0.646 . . . . 25.0 112.796 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -66.35 -6.85 15.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.807 1.643 . . . . 25.0 112.417 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.5 t-105 -109.25 113.49 26.37 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 106.412 -1.699 . . . . 25.0 106.412 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -107.86 153.97 22.25 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.587 0.958 . . . . 25.0 113.587 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -98.63 126.77 44.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.268 2.227 . . . . 25.0 105.162 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.1 m -141.35 170.67 13.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.265 1.031 . . . . 25.0 112.978 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -128.73 125.09 37.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 127.637 2.375 . . . . 25.0 108.079 176.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 t -77.7 122.63 25.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 106.753 -1.573 . . . . 25.0 106.753 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.8 mt -78.56 -16.72 57.11 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.597 0.759 . . . . 25.0 111.694 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.9 m -86.68 -43.23 12.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.572 1.149 . . . . 25.0 111.542 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -98.05 -21.8 16.6 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.438 0.903 . . . . 25.0 113.438 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.02 1.74 87.95 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-O 118.297 -1.28 . . . . 25.0 112.499 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -88.04 165.12 15.39 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 119.02 1.41 . . . . 25.0 111.729 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.7 p -122.22 149.14 44.08 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.026 1.331 . . . . 25.0 111.851 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.64 -168.6 39.15 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 125.338 1.447 . . . . 25.0 111.864 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -116.39 142.72 46.49 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.486 1.114 . . . . 25.0 109.966 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.7 pt -145.43 157.56 52.29 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 124.897 1.279 . . . . 25.0 110.659 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.99 124.37 10.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.793 2.995 . . . . 25.0 110.367 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.0 p -57.51 -35.93 40.21 Favored Pre-proline 0 CA--C 1.55 0.948 0 N-CA-C 117.174 2.287 . . . . 25.0 117.174 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.25 -16.0 52.65 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.819 2.346 . . . . 25.0 114.871 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -78.34 -5.41 52.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.094 -0.955 . . . . 25.0 112.103 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.4 mt -119.47 157.98 27.18 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 124.175 0.99 . . . . 25.0 111.433 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.53 138.14 17.12 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 126.653 1.981 . . . . 25.0 108.787 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.75 146.94 80.29 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.85 2.367 . . . . 25.0 111.568 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.533 0.314 0 C-N-CA 124.686 1.194 . . . . 25.0 108.39 179.741 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 71.8 mt . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -122.85 145.7 48.21 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 123.675 0.79 . . . . 25.0 109.713 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -123.82 151.42 43.4 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.629 1.572 . . . . 25.0 110.195 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.01 134.8 36.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.956 1.302 . . . . 25.0 113.236 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.54 -26.56 17.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.284 1.434 . . . . 25.0 111.599 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -147.71 156.35 42.67 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.978 1.311 . . . . 25.0 110.344 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.08 149.16 37.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.083 0.553 . . . . 25.0 109.782 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -148.16 137.9 22.38 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.226 1.01 . . . . 25.0 109.946 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -114.34 138.8 50.07 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.152 -1.425 . . . . 25.0 107.152 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.98 128.36 36.47 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.49 1.116 . . . . 25.0 111.076 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -85.94 -25.16 26.24 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.932 1.293 . . . . 25.0 112.087 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 43.9 p -130.48 170.83 13.71 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.018 1.327 . . . . 25.0 110.211 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -68.1 -17.31 64.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.151 0.98 . . . . 25.0 112.487 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.18 -3.12 27.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.645 1.578 . . . . 25.0 112.635 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.7 156.77 17.34 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.258 1.023 . . . . 25.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.7 mt -104.55 137.67 42.05 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.099 1.36 . . . . 25.0 111.442 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.7 m -96.73 145.75 25.51 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.158 1.383 . . . . 25.0 107.87 177.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -158.6 171.11 20.72 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 122.048 0.928 . . . . 25.0 111.859 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -123.09 159.71 27.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.048 1.739 . . . . 25.0 108.053 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.23 134.06 44.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.25 1.02 . . . . 25.0 109.829 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.6 -9.31 68.92 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.06 -1.411 . . . . 25.0 114.129 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -69.74 135.82 50.22 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 119.544 1.672 . . . . 25.0 110.108 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -99.78 151.07 21.67 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.579 0.752 . . . . 25.0 112.255 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -141.83 157.28 45.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.495 1.918 . . . . 25.0 111.675 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -116.14 134.6 54.76 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.695 1.998 . . . . 25.0 106.302 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.5 mm -82.47 126.64 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.645 0.778 . . . . 25.0 111.484 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -98.95 -42.85 6.94 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.585 1.154 . . . . 25.0 108.873 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.68 125.69 5.4 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 124.524 1.13 . . . . 25.0 109.177 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.3 p -125.68 12.47 7.97 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.317 1.599 . . . . 25.0 115.317 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.9 p -92.61 1.19 57.4 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.863 1.265 . . . . 25.0 113.42 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -90.22 16.13 9.15 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.618 1.567 . . . . 25.0 113.595 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.81 -157.9 18.58 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 118.705 0.684 . . . . 25.0 111.946 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.43 -5.43 19.17 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.069 1.348 . . . . 25.0 111.627 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -106.1 110.13 22.29 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.236 1.815 . . . . 25.0 106.358 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -107.68 149.49 28.06 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 113.362 0.875 . . . . 25.0 113.362 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -95.41 128.05 41.95 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.703 2.001 . . . . 25.0 105.719 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -141.74 170.5 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 122.23 1.014 . . . . 25.0 112.927 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -123.66 125.86 45.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 127.346 2.258 . . . . 25.0 106.38 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -76.71 119.66 20.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.492 -1.299 . . . . 25.0 107.492 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.4 mt -74.87 -18.72 60.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.541 0.736 . . . . 25.0 111.641 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.7 m -91.03 -44.5 9.27 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.395 1.078 . . . . 25.0 112.738 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.2 p -99.05 -21.39 16.23 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.29 1.219 . . . . 25.0 114.29 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.55 1.2 90.05 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.352 -1.249 . . . . 25.0 112.576 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.41 160.69 20.56 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.081 1.441 . . . . 25.0 110.943 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 p -120.2 144.31 47.79 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.315 1.046 . . . . 25.0 110.805 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.57 -168.34 38.79 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.519 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -114.93 141.58 47.76 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 125.159 1.384 . . . . 25.0 110.759 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 pt -144.17 150.56 49.16 Favored Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.27 1.428 . . . . 25.0 109.536 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.68 122.89 9.58 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.546 2.83 . . . . 25.0 111.647 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.8 p -59.35 -36.17 38.46 Favored Pre-proline 0 CA--C 1.548 0.893 0 CA-C-O 116.049 -1.929 . . . . 25.0 115.813 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -64.62 -18.59 63.23 Favored 'Trans proline' 0 C--N 1.362 1.248 0 CA-C-N 123.101 2.143 . . . . 25.0 114.624 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -79.32 -4.08 49.15 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.759 0.823 . . . . 25.0 111.0 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.5 mt -118.73 158.45 25.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.25 1.42 . . . . 25.0 112.907 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.79 144.79 43.17 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.572 2.349 . . . . 25.0 108.125 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.25 147.15 91.11 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.829 2.353 . . . . 25.0 111.573 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.899 1.28 . . . . 25.0 108.798 179.862 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 mt . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.853 0.358 . . . . 25.0 110.101 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -131.14 151.39 51.5 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.195 1.398 . . . . 25.0 109.716 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -126.2 153.03 45.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 25.0 110.363 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.81 131.14 35.37 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.362 1.465 . . . . 25.0 112.505 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.8 mt -89.43 -30.41 18.34 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.684 1.594 . . . . 25.0 111.523 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -153.06 163.9 38.99 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.232 1.813 . . . . 25.0 109.681 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.12 149.14 38.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.948 0.899 . . . . 25.0 111.458 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -145.19 137.09 25.6 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.128 1.371 . . . . 25.0 109.628 178.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -113.01 134.88 54.31 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.696 -1.224 . . . . 25.0 107.696 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.97 129.12 39.81 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.446 1.098 . . . . 25.0 109.964 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -93.76 -21.46 19.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.023 0.929 . . . . 25.0 112.567 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.8 p -129.86 171.1 13.08 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.884 1.274 . . . . 25.0 110.36 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.19 -18.36 63.91 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.033 0.933 . . . . 25.0 111.918 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -97.41 -3.64 39.79 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.88 1.672 . . . . 25.0 112.264 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -94.87 158.49 15.46 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.313 1.045 . . . . 25.0 111.296 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.5 mt -111.97 140.11 46.9 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.297 1.439 . . . . 25.0 109.998 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.4 m -95.85 145.8 25.07 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 107.582 -1.266 . . . . 25.0 107.582 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -155.24 169.45 24.14 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 122.021 0.915 . . . . 25.0 110.942 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -123.14 160.4 26.55 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.432 1.493 . . . . 25.0 108.228 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -54.31 134.14 45.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.76 1.224 . . . . 25.0 109.881 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.84 -11.28 68.12 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 125.115 1.34 . . . . 25.0 113.837 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -71.5 137.75 48.4 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 119.376 1.588 . . . . 25.0 110.064 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -106.75 153.27 22.69 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-O 121.781 0.801 . . . . 25.0 112.218 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -140.51 157.91 44.79 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.654 1.982 . . . . 25.0 112.532 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -113.85 136.16 53.17 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 105.105 -2.183 . . . . 25.0 105.105 177.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 46.5 mm -82.25 124.36 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.457 0.703 . . . . 25.0 111.199 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 47.9 mt -90.92 -44.03 9.62 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -159.87 129.92 5.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.507 1.123 . . . . 25.0 109.09 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.2 p -125.51 12.45 8.07 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 115.722 1.749 . . . . 25.0 115.722 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.6 p -95.18 5.32 52.12 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.65 1.18 . . . . 25.0 112.718 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -88.51 13.91 10.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.23 1.812 . . . . 25.0 113.788 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.62 -158.0 18.69 Favored Glycine 0 C--N 1.343 0.934 0 N-CA-C 111.633 -0.587 . . . . 25.0 111.633 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -67.85 -7.18 25.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.914 1.286 . . . . 25.0 111.365 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -107.6 116.14 31.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.984 2.114 . . . . 25.0 106.382 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -111.7 153.83 25.87 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.473 0.916 . . . . 25.0 113.473 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -97.28 130.49 44.46 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 126.879 2.072 . . . . 25.0 106.041 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.5 m -140.14 166.74 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 122.256 1.027 . . . . 25.0 113.678 -178.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 -125.37 122.82 37.89 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.309 2.244 . . . . 25.0 105.827 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.8 t -76.33 123.14 25.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.803 -0.814 . . . . 25.0 108.803 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.17 -19.43 58.46 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.847 0.859 . . . . 25.0 110.975 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.3 m -88.32 -45.92 9.62 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.165 1.386 . . . . 25.0 112.491 -179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.8 p -97.63 -21.55 16.98 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.915 1.08 . . . . 25.0 113.915 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.33 1.81 88.69 Favored Glycine 0 CA--C 1.538 1.482 0 CA-C-O 118.419 -1.211 . . . . 25.0 112.608 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -87.54 167.18 14.17 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 118.974 1.387 . . . . 25.0 111.417 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 51.3 p -121.0 145.34 47.87 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.771 1.228 . . . . 25.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.56 -168.46 38.99 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.453 1.025 . . . . 25.0 112.646 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -117.19 142.93 46.42 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.914 1.286 . . . . 25.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.4 pt -146.23 150.56 41.84 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.807 1.243 . . . . 25.0 110.283 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.29 123.39 10.21 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.89 3.06 . . . . 25.0 111.464 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.5 p -58.97 -35.84 36.47 Favored Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 116.589 2.07 . . . . 25.0 116.589 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -64.84 -18.53 62.66 Favored 'Trans proline' 0 C--N 1.361 1.207 0 CA-C-N 123.277 2.206 . . . . 25.0 114.797 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.87 -4.18 48.36 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.04 0.836 . . . . 25.0 110.716 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.1 mt -119.82 159.25 24.94 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 125.749 1.62 . . . . 25.0 112.6 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.8 139.46 30.75 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.852 2.061 . . . . 25.0 107.98 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.28 142.52 73.48 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.541 2.161 . . . . 25.0 110.046 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 86.1 t . . . . . 0 CA--C 1.533 0.313 0 C-N-CA 123.73 0.812 . . . . 25.0 108.945 -179.596 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 CA--C 1.536 0.409 0 N-CA-C 108.723 -0.843 . . . . 25.0 108.723 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -131.29 148.39 52.68 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.33 1.052 . . . . 25.0 109.979 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -125.58 155.54 40.53 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.077 1.351 . . . . 25.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.01 133.55 37.96 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.329 1.452 . . . . 25.0 113.624 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.08 -29.34 18.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.265 1.826 . . . . 25.0 112.071 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -152.04 161.5 42.53 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 125.723 1.609 . . . . 25.0 110.093 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -61.04 149.22 37.63 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.984 0.514 . . . . 25.0 109.795 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -145.51 138.58 26.2 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.179 0.991 . . . . 25.0 110.308 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -117.15 135.28 53.88 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.181 -1.414 . . . . 25.0 107.181 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.46 131.18 49.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.077 1.351 . . . . 25.0 111.65 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.2 mtp-105 -83.2 -29.36 28.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 25.0 111.628 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.3 p -131.61 173.62 10.94 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.202 1.401 . . . . 25.0 111.418 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -68.04 -18.65 64.75 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.107 1.363 . . . . 25.0 112.705 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -97.3 -6.33 34.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.463 1.505 . . . . 25.0 112.421 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -95.3 155.95 16.52 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.876 1.27 . . . . 25.0 109.305 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.0 mt -109.95 143.41 39.95 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 124.487 1.115 . . . . 25.0 110.796 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 70.1 m -96.8 147.8 23.56 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.11 1.364 . . . . 25.0 108.116 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -156.07 170.0 23.2 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.755 0.788 . . . . 25.0 111.226 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -120.7 157.24 30.07 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.263 1.425 . . . . 25.0 108.488 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -54.23 134.18 44.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.845 1.258 . . . . 25.0 110.4 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.62 -8.48 68.69 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 125.25 1.405 . . . . 25.0 113.752 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -70.34 133.14 46.65 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 119.168 1.484 . . . . 25.0 110.681 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -97.79 152.69 18.89 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 123.778 0.831 . . . . 25.0 110.971 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -140.29 154.51 46.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.536 1.534 . . . . 25.0 111.564 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -110.14 130.04 55.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 104.53 -2.396 . . . . 25.0 104.53 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -82.9 125.4 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 123.148 0.579 . . . . 25.0 111.009 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.1 mt -95.27 -41.85 8.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.606 1.162 . . . . 25.0 109.341 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -158.58 129.09 6.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.566 1.146 . . . . 25.0 109.401 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 79.8 p -125.6 12.38 8.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.491 1.664 . . . . 25.0 115.491 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.6 p -94.19 2.44 55.93 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.684 1.193 . . . . 25.0 113.298 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -88.57 14.56 9.64 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.689 1.596 . . . . 25.0 114.036 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.67 -158.02 18.66 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 118.533 0.606 . . . . 25.0 112.706 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.4 -2.9 9.5 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.641 1.576 . . . . 25.0 112.258 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.4 t-105 -117.43 120.2 37.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 105.573 -2.01 . . . . 25.0 105.573 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.16 157.54 20.73 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 114.695 1.368 . . . . 25.0 114.695 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -96.97 125.24 41.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.353 2.261 . . . . 25.0 105.346 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.43 171.53 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 122.148 0.975 . . . . 25.0 112.786 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -122.51 125.74 46.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.393 2.277 . . . . 25.0 108.012 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -77.87 119.16 20.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.245 -1.761 . . . . 25.0 106.245 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.86 -17.44 59.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.737 0.815 . . . . 25.0 112.057 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.5 m -84.08 -44.47 14.04 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.747 1.219 . . . . 25.0 112.217 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -100.61 -19.33 16.16 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.023 1.12 . . . . 25.0 114.023 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.12 1.86 88.29 Favored Glycine 0 CA--C 1.539 1.536 0 CA-C-O 118.608 -1.107 . . . . 25.0 112.164 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -83.06 167.15 18.14 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 118.776 1.288 . . . . 25.0 111.153 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 38.3 p -125.05 147.85 48.78 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.707 1.203 . . . . 25.0 110.462 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.82 -168.55 38.97 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.49 1.043 . . . . 25.0 112.044 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -120.12 140.35 51.21 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.418 1.087 . . . . 25.0 110.338 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.0 pt -147.24 156.6 46.41 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.176 1.39 . . . . 25.0 110.793 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.16 123.13 9.98 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.903 3.069 . . . . 25.0 112.755 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 p -59.94 -35.47 28.92 Favored Pre-proline 0 CA--C 1.551 1.016 0 CA-C-O 115.785 -2.055 . . . . 25.0 115.509 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.3 -18.98 65.15 Favored 'Trans proline' 0 C--N 1.363 1.312 0 CA-C-N 123.488 2.281 . . . . 25.0 114.245 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -79.12 -3.12 43.89 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 119.064 0.847 . . . . 25.0 110.335 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 46.2 mt -119.13 158.18 26.43 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.831 1.653 . . . . 25.0 111.494 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.41 142.74 35.89 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.133 2.173 . . . . 25.0 108.478 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.61 145.95 92.06 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.738 2.292 . . . . 25.0 111.03 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.9 t . . . . . 0 CA--C 1.533 0.309 0 C-N-CA 124.115 0.966 . . . . 25.0 108.468 -179.843 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 121.427 0.632 . . . . 25.0 111.361 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -134.63 148.21 50.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.382 1.873 . . . . 25.0 107.671 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -127.46 153.38 46.36 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.628 0.771 . . . . 25.0 111.655 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.57 132.76 42.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.051 1.74 . . . . 25.0 112.495 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -91.8 -28.75 17.16 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.976 1.71 . . . . 25.0 111.887 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -150.86 160.15 44.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.734 1.614 . . . . 25.0 109.652 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -61.04 149.17 37.79 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.717 -0.475 . . . . 25.0 109.717 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -146.55 135.72 22.66 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 124.179 0.991 . . . . 25.0 108.927 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -114.54 139.32 49.68 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.6 126.83 29.15 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.564 1.145 . . . . 25.0 110.558 -179.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -86.46 -24.26 25.69 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.742 1.217 . . . . 25.0 111.727 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -129.3 170.11 14.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.454 1.502 . . . . 25.0 109.977 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.78 -16.83 64.31 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.462 1.105 . . . . 25.0 113.02 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.74 -2.45 28.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.572 1.549 . . . . 25.0 113.105 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -91.73 157.98 16.62 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.08 0.952 . . . . 25.0 110.657 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.24 138.05 39.68 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.27 1.428 . . . . 25.0 111.225 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -99.43 142.88 30.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.154 1.382 . . . . 25.0 107.459 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -159.93 173.83 15.32 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.551 0.691 . . . . 25.0 111.942 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -126.01 159.87 31.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.333 1.453 . . . . 25.0 110.374 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -54.19 134.35 44.53 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.321 1.848 . . . . 25.0 110.993 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.12 -11.27 69.46 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.348 1.452 . . . . 25.0 114.107 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -74.2 137.77 43.31 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 118.88 1.34 . . . . 25.0 109.998 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -100.2 153.58 19.15 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.735 0.814 . . . . 25.0 111.245 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -140.01 153.02 46.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.652 1.581 . . . . 25.0 112.238 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -105.35 131.26 53.02 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.643 1.977 . . . . 25.0 105.75 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.38 123.17 38.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.101 -0.703 . . . . 25.0 109.101 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -93.03 -44.62 8.31 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.873 0.869 . . . . 25.0 109.737 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.05 130.04 8.6 Favored 'General case' 0 C--N 1.346 0.418 0 C-N-CA 123.652 0.781 . . . . 25.0 110.074 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.9 p -125.59 12.32 8.01 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.158 1.383 . . . . 25.0 114.584 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.1 p -93.9 -2.3 53.52 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.896 1.278 . . . . 25.0 113.04 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -86.19 15.53 5.12 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.518 1.527 . . . . 25.0 112.922 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.78 -158.19 18.56 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-O 121.506 0.503 . . . . 25.0 112.362 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -66.16 -12.14 53.93 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.488 1.515 . . . . 25.0 111.719 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.7 t-105 -101.57 114.61 28.79 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.374 1.869 . . . . 25.0 106.25 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -105.75 150.64 25.33 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 113.403 0.89 . . . . 25.0 113.403 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -96.87 129.38 44.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.541 1.936 . . . . 25.0 105.936 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.41 168.96 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 121.962 0.887 . . . . 25.0 112.671 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -125.88 128.67 47.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.033 2.133 . . . . 25.0 106.922 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 t -78.66 125.03 28.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.371 -0.974 . . . . 25.0 108.371 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.03 -17.15 61.47 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.352 0.661 . . . . 25.0 111.012 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 86.3 m -90.95 -46.21 8.3 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.09 1.356 . . . . 25.0 112.971 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.5 p -100.4 -21.97 15.21 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.514 1.301 . . . . 25.0 114.514 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.35 1.39 85.98 Favored Glycine 0 CA--C 1.537 1.455 0 CA-C-O 118.713 -1.048 . . . . 25.0 112.364 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -81.32 157.93 24.91 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 118.726 1.263 . . . . 25.0 110.727 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.8 p -119.65 144.89 46.92 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.129 0.972 . . . . 25.0 110.286 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.6 -168.37 38.82 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.212 1.387 . . . . 25.0 111.091 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -115.16 140.28 49.21 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.857 0.863 . . . . 25.0 110.706 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.7 pt -141.01 153.22 66.97 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.107 1.363 . . . . 25.0 109.743 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.35 122.89 9.69 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.359 2.706 . . . . 25.0 112.007 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 p -59.74 -36.6 41.17 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 116.11 -1.9 . . . . 25.0 115.205 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.08 -18.56 62.05 Favored 'Trans proline' 0 C--N 1.362 1.248 0 C-N-CA 122.627 2.218 . . . . 25.0 114.659 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.6 -2.31 38.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.205 1.002 . . . . 25.0 110.784 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.1 mt -118.19 158.48 25.03 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.035 1.334 . . . . 25.0 112.753 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.43 138.02 23.72 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.822 2.049 . . . . 25.0 108.304 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.68 138.36 49.07 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.955 2.436 . . . . 25.0 112.17 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.7 t . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 125.646 1.578 . . . . 25.0 108.076 178.437 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 25.0 110.056 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -130.4 146.48 51.97 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.551 1.541 . . . . 25.0 108.408 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -123.32 152.31 41.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.452 1.101 . . . . 25.0 110.937 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.15 134.89 37.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.824 1.65 . . . . 25.0 112.951 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.3 mt -89.6 -29.06 19.11 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.18 1.792 . . . . 25.0 111.909 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -153.8 162.75 40.97 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 125.752 1.621 . . . . 25.0 110.167 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.19 149.26 38.1 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.526 0.73 . . . . 25.0 109.93 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -146.79 135.82 22.47 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.979 0.912 . . . . 25.0 109.277 178.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -110.08 136.58 49.1 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.52 127.05 29.6 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.95 0.9 . . . . 25.0 109.534 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 -87.71 -22.23 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.075 0.95 . . . . 25.0 111.698 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -134.08 171.74 13.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.583 1.553 . . . . 25.0 110.214 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -69.03 -17.37 63.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.994 0.918 . . . . 25.0 111.903 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -96.66 -6.17 37.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.92 1.688 . . . . 25.0 112.444 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -94.83 157.86 15.74 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.564 1.146 . . . . 25.0 110.542 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 mt -106.92 139.85 40.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.229 1.412 . . . . 25.0 110.856 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.6 m -97.64 143.38 28.37 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -159.31 173.82 15.71 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.675 0.75 . . . . 25.0 111.382 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -124.3 158.98 31.28 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.362 1.465 . . . . 25.0 109.436 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.31 44.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 25.0 110.849 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.26 -9.27 72.28 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 125.157 1.361 . . . . 25.0 113.797 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.44 135.57 48.81 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.038 1.419 . . . . 25.0 109.631 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -99.75 151.8 20.83 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 121.559 0.695 . . . . 25.0 111.599 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -139.78 157.0 46.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.685 1.594 . . . . 25.0 112.832 -177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -105.9 130.45 53.86 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 127.014 2.126 . . . . 25.0 105.439 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.8 mm -82.94 121.21 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.5 mt -92.79 -43.16 9.16 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.989 0.915 . . . . 25.0 108.741 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.95 128.47 6.3 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 124.018 0.927 . . . . 25.0 109.516 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 82.4 p -125.61 12.4 8.01 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.407 1.632 . . . . 25.0 115.407 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -97.44 0.71 48.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.995 1.318 . . . . 25.0 114.243 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -88.16 15.98 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.205 1.402 . . . . 25.0 113.671 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.65 -157.89 18.69 Favored Glycine 0 C--N 1.344 1.027 0 N-CA-C 111.255 -0.738 . . . . 25.0 111.255 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.21 -7.26 28.76 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.351 1.06 . . . . 25.0 111.503 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.2 t-105 -103.12 111.64 24.1 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.26 1.824 . . . . 25.0 106.447 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -111.01 153.17 25.96 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.702 0.801 . . . . 25.0 112.736 -178.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -99.09 128.39 45.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.631 1.972 . . . . 25.0 106.178 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.5 m -142.86 169.73 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.079 0.942 . . . . 25.0 112.887 -179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -124.85 126.9 46.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.247 2.219 . . . . 25.0 108.305 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.8 t -78.13 121.69 24.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.022 -1.473 . . . . 25.0 107.022 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.2 mt -78.54 -16.66 57.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.466 0.706 . . . . 25.0 111.19 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -88.67 -45.06 10.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.777 1.231 . . . . 25.0 111.725 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.6 p -95.82 -21.83 17.86 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.336 0.865 . . . . 25.0 113.336 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.07 1.04 89.77 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.085 -1.397 . . . . 25.0 112.832 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -89.85 164.55 14.57 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 119.342 1.571 . . . . 25.0 111.945 -178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.6 p -120.48 147.76 44.71 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 125.071 1.348 . . . . 25.0 111.37 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.54 -168.42 38.93 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.948 1.261 . . . . 25.0 111.9 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -115.24 140.52 49.03 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.323 1.049 . . . . 25.0 110.299 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.0 pt -143.41 149.1 46.58 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.657 1.183 . . . . 25.0 109.236 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -68.7 124.43 11.51 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.867 3.045 . . . . 25.0 111.646 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.6 p -58.08 -35.45 33.95 Favored Pre-proline 0 CA--C 1.549 0.942 0 CA-C-O 115.719 -2.086 . . . . 25.0 116.392 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -64.31 -18.34 62.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 CA-C-N 123.394 2.248 . . . . 25.0 114.044 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.43 -3.63 47.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.742 0.817 . . . . 25.0 110.255 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.2 mt -119.78 158.83 25.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.94 1.696 . . . . 25.0 112.252 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.6 136.96 16.94 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.231 2.213 . . . . 25.0 107.275 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.73 145.85 87.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.735 2.29 . . . . 25.0 111.83 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.2 t . . . . . 0 CA--C 1.534 0.362 0 N-CA-C 107.466 -1.309 . . . . 25.0 107.466 179.12 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.0 mt . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 109.325 -0.62 . . . . 25.0 109.325 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -130.39 148.01 52.16 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.821 1.248 . . . . 25.0 109.154 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -126.25 156.07 40.88 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.616 1.166 . . . . 25.0 111.157 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.81 134.36 36.99 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.394 1.478 . . . . 25.0 112.68 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -87.77 -29.36 21.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.632 1.573 . . . . 25.0 112.143 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -154.69 165.79 35.45 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 126.099 1.759 . . . . 25.0 109.92 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.28 149.18 38.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.728 0.811 . . . . 25.0 110.654 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -149.58 135.92 19.1 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.543 1.137 . . . . 25.0 109.308 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -113.12 137.45 51.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.411 -1.7 . . . . 25.0 106.411 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.89 127.66 33.33 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.039 0.936 . . . . 25.0 111.019 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.0 mtp-105 -88.42 -22.93 23.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.334 1.453 . . . . 25.0 111.728 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.2 p -133.1 170.13 15.84 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 25.0 109.814 179.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.6 -18.6 63.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.364 0.666 . . . . 25.0 111.861 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -95.17 -6.55 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.735 1.614 . . . . 25.0 112.096 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -90.66 151.42 21.28 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.809 0.843 . . . . 25.0 110.75 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.3 mt -100.67 134.46 43.59 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.251 1.42 . . . . 25.0 109.222 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.9 m -91.65 142.78 27.24 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.936 -1.505 . . . . 25.0 106.936 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -154.15 168.04 27.84 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 121.654 0.74 . . . . 25.0 111.845 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -125.06 157.81 35.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.175 1.39 . . . . 25.0 108.755 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.18 134.15 44.44 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.355 1.062 . . . . 25.0 110.306 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.26 -8.87 69.72 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-O 118.302 -1.277 . . . . 25.0 113.732 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -69.93 132.22 45.63 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 119.147 1.474 . . . . 25.0 110.388 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -97.9 152.06 19.61 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.025 0.93 . . . . 25.0 110.556 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -140.68 155.4 46.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.736 1.214 . . . . 25.0 112.615 -178.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -106.01 130.19 53.98 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.16 122.3 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 123.368 0.667 . . . . 25.0 109.962 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.8 mt -99.58 -44.35 6.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.001 0.92 . . . . 25.0 110.06 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.45 128.46 7.39 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.702 0.801 . . . . 25.0 110.824 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.7 m -125.7 12.54 7.97 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.057 1.343 . . . . 25.0 113.549 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.2 p -93.38 -2.69 54.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.101 0.961 . . . . 25.0 113.525 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -87.82 15.69 6.75 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.385 1.474 . . . . 25.0 113.415 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.94 18.63 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 118.526 0.603 . . . . 25.0 111.964 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -67.26 -9.6 42.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.902 1.281 . . . . 25.0 111.411 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -100.01 107.54 19.5 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 105.948 -1.871 . . . . 25.0 105.948 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m0 -105.13 151.78 23.61 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -98.67 128.03 44.8 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.225 -1.769 . . . . 25.0 106.225 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.6 m -141.62 168.81 14.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.574 0.75 . . . . 25.0 111.085 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.3 ttt-85 -117.73 123.77 46.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.875 -1.528 . . . . 25.0 106.875 177.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.5 t -75.62 116.39 16.29 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 105.941 -1.874 . . . . 25.0 105.941 178.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -77.66 -16.88 58.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.825 0.85 . . . . 25.0 111.536 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -87.87 -46.69 9.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 25.0 111.826 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.8 p -93.5 -20.71 20.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.45 0.907 . . . . 25.0 113.45 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.26 4.38 90.48 Favored Glycine 0 CA--C 1.538 1.489 0 CA-C-O 118.471 -1.183 . . . . 25.0 112.254 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.89 167.15 13.05 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 119.016 1.408 . . . . 25.0 111.688 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.4 p -121.76 145.12 48.36 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.297 1.439 . . . . 25.0 109.125 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.68 -168.31 38.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.85 0.738 . . . . 25.0 112.633 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -120.16 141.41 49.89 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.874 1.27 . . . . 25.0 111.032 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 pt -146.41 152.86 47.02 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.914 1.285 . . . . 25.0 110.087 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.51 123.47 10.54 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.435 2.756 . . . . 25.0 111.303 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.1 p -58.24 -35.7 36.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 CA-C-O 115.921 -1.99 . . . . 25.0 116.235 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.37 -18.43 63.09 Favored 'Trans proline' 0 C--N 1.361 1.208 0 CA-C-N 123.184 2.173 . . . . 25.0 114.432 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.15 -3.6 46.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.003 0.82 . . . . 25.0 110.702 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.6 mt -118.83 158.43 25.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.813 1.645 . . . . 25.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.29 138.13 26.3 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 127.036 2.134 . . . . 25.0 108.295 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.71 141.24 53.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.731 2.287 . . . . 25.0 111.913 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.4 t . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 107.288 -1.375 . . . . 25.0 107.288 178.459 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 108.824 -0.806 . . . . 25.0 108.824 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -130.38 148.99 52.26 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.734 1.214 . . . . 25.0 109.924 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.12 155.53 35.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.156 1.382 . . . . 25.0 110.127 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.88 130.78 35.22 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.872 1.269 . . . . 25.0 112.697 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.2 mt -89.34 -30.12 18.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 25.0 111.293 178.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -148.45 157.11 43.26 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 125.39 1.476 . . . . 25.0 110.152 -178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -61.04 149.27 37.49 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.27 0.628 . . . . 25.0 110.288 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -144.3 137.31 27.11 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.72 1.208 . . . . 25.0 110.149 178.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -114.56 135.31 54.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.995 -1.484 . . . . 25.0 106.995 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.82 128.96 39.1 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.324 1.05 . . . . 25.0 111.314 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -83.87 -29.01 27.56 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.419 1.488 . . . . 25.0 112.038 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 p -132.12 171.66 13.36 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.205 1.402 . . . . 25.0 110.542 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.75 -17.21 64.01 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.019 0.927 . . . . 25.0 111.833 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -95.08 -5.13 45.0 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.149 1.78 . . . . 25.0 112.301 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -97.31 156.56 16.39 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.272 1.029 . . . . 25.0 111.479 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.3 mt -104.44 136.76 43.41 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.562 1.545 . . . . 25.0 110.659 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.6 m -95.02 145.47 24.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -154.67 169.53 23.67 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.822 0.82 . . . . 25.0 111.636 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -125.43 158.43 34.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.392 1.477 . . . . 25.0 108.932 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -54.3 134.21 45.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.763 1.225 . . . . 25.0 110.0 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.59 -11.52 68.37 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 125.06 1.314 . . . . 25.0 113.552 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.83 134.16 47.11 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 119.194 1.497 . . . . 25.0 110.032 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -100.95 154.02 19.03 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.562 0.745 . . . . 25.0 111.243 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -140.39 154.93 46.88 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.956 1.302 . . . . 25.0 113.737 -177.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -107.11 129.23 54.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 104.049 -2.575 . . . . 25.0 104.049 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.7 mm -81.36 121.11 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 123.197 0.599 . . . . 25.0 109.913 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -93.04 -42.5 9.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.229 1.012 . . . . 25.0 109.205 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.06 126.87 6.22 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.985 0.914 . . . . 25.0 109.913 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.4 p -125.74 12.4 7.93 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.797 1.406 . . . . 25.0 114.797 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.0 p -96.47 -2.16 45.88 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.246 1.419 . . . . 25.0 114.391 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.53 16.31 6.75 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.13 1.372 . . . . 25.0 113.952 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.95 18.63 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 118.75 0.705 . . . . 25.0 112.831 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -67.86 -0.21 4.02 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.734 1.614 . . . . 25.0 112.071 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.6 t-105 -115.92 112.21 21.55 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.834 2.053 . . . . 25.0 106.166 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -110.11 154.12 23.74 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.013 0.925 . . . . 25.0 113.069 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -98.43 127.43 44.36 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 105.426 -2.065 . . . . 25.0 105.426 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.8 m -141.09 168.78 15.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.715 0.769 . . . . 25.0 111.694 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -121.42 123.2 41.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.565 1.546 . . . . 25.0 107.913 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.4 t -74.42 118.34 17.27 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.174 -2.158 . . . . 25.0 105.174 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.45 -12.45 60.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.521 0.728 . . . . 25.0 112.086 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.0 m -88.62 -43.83 11.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.897 1.279 . . . . 25.0 111.567 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 p -98.93 -21.05 16.46 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.987 1.106 . . . . 25.0 113.987 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.14 3.4 89.6 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 118.454 -1.192 . . . . 25.0 112.441 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -85.71 161.48 19.18 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.051 1.425 . . . . 25.0 111.354 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.0 p -120.6 145.32 47.5 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.873 1.269 . . . . 25.0 110.623 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.53 -168.25 38.67 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 124.541 1.067 . . . . 25.0 112.383 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.98 149.24 35.61 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.208 1.403 . . . . 25.0 111.746 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.0 pt -150.04 157.69 37.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.253 1.421 . . . . 25.0 111.003 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -71.26 122.13 8.42 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.978 2.452 . . . . 25.0 108.593 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.4 p -58.39 -35.19 30.59 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 116.953 2.205 . . . . 25.0 116.953 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -63.85 -16.21 53.51 Favored 'Trans proline' 0 C--N 1.36 1.184 0 C-N-CA 122.755 2.303 . . . . 25.0 115.199 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -77.83 -5.21 50.1 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.332 0.969 . . . . 25.0 111.817 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 33.0 mt -119.33 158.46 26.05 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.515 1.126 . . . . 25.0 112.274 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.25 143.26 32.84 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 127.596 2.358 . . . . 25.0 108.428 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -62.44 146.59 95.6 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.809 2.34 . . . . 25.0 111.272 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 CA--C 1.532 0.264 0 C-N-CA 123.971 0.909 . . . . 25.0 109.919 -178.891 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 119.322 -0.371 . . . . 25.0 110.051 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 t -149.49 157.66 43.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.331 1.453 . . . . 25.0 110.521 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.58 160.83 26.27 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.592 -0.892 . . . . 25.0 108.592 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -130.16 147.97 51.95 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.247 1.019 . . . . 25.0 109.366 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -121.5 152.65 38.93 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.092 1.357 . . . . 25.0 110.705 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.89 135.57 35.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.201 1.4 . . . . 25.0 113.366 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 86.1 mt -98.47 -24.56 15.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.064 1.745 . . . . 25.0 112.242 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.03 153.04 38.43 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.557 1.143 . . . . 25.0 110.527 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.1 149.22 37.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 109.332 -0.618 . . . . 25.0 109.332 175.686 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -146.61 137.23 23.93 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.719 0.807 . . . . 25.0 109.592 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -112.89 136.87 52.06 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 106.972 -1.492 . . . . 25.0 106.972 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.39 127.92 34.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.261 1.025 . . . . 25.0 110.068 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -93.59 -20.42 20.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.422 1.089 . . . . 25.0 112.338 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.0 p -130.07 171.27 13.0 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.027 1.331 . . . . 25.0 110.119 179.142 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.06 -18.97 64.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.248 1.019 . . . . 25.0 112.366 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -101.96 -2.93 28.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.771 1.628 . . . . 25.0 112.815 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.0 156.06 18.24 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.28 0.945 . . . . 25.0 110.87 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 mt -107.22 140.47 40.04 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.314 1.446 . . . . 25.0 110.787 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.5 m -97.5 145.07 26.58 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.674 1.19 . . . . 25.0 107.834 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -156.82 170.81 21.62 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.714 0.769 . . . . 25.0 111.074 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -122.87 156.81 33.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.337 1.455 . . . . 25.0 108.727 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.21 44.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.702 1.201 . . . . 25.0 110.198 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.45 -9.54 66.93 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.343 1.449 . . . . 25.0 113.38 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.34 133.97 46.38 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.066 1.433 . . . . 25.0 110.19 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -102.05 152.62 20.76 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.69 0.796 . . . . 25.0 110.616 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.3 156.23 48.5 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.292 1.437 . . . . 25.0 112.822 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -107.45 128.98 54.97 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 104.648 -2.353 . . . . 25.0 104.648 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.5 mm -82.07 123.0 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.511 0.725 . . . . 25.0 110.995 -177.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.0 mt -91.45 -44.48 9.09 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.171 -1.048 . . . . 25.0 108.171 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -158.83 127.46 5.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.408 1.083 . . . . 25.0 108.948 178.314 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.2 p -125.62 12.5 8.01 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.6 p -93.28 5.32 51.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.524 1.13 . . . . 25.0 112.773 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -91.15 12.43 20.05 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.846 1.658 . . . . 25.0 114.711 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.66 -157.81 18.7 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 118.651 0.66 . . . . 25.0 111.529 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -69.47 -1.12 7.7 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.883 1.273 . . . . 25.0 111.717 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -112.15 105.74 14.17 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.52 1.928 . . . . 25.0 106.456 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -105.38 151.08 24.64 Favored 'General case' 0 C--N 1.345 0.385 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -96.02 126.37 41.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.472 -2.048 . . . . 25.0 105.472 177.818 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.1 m -142.86 168.28 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.933 0.873 . . . . 25.0 112.605 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -121.35 127.62 51.45 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.522 1.929 . . . . 25.0 107.738 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.7 t -76.54 119.66 20.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 106.788 -1.56 . . . . 25.0 106.788 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.4 mt -76.74 -15.9 59.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.334 0.654 . . . . 25.0 111.207 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.6 m -87.59 -46.08 9.86 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.146 1.378 . . . . 25.0 112.265 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.9 p -101.19 -21.05 15.03 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.472 1.286 . . . . 25.0 114.472 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.76 2.34 90.5 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.558 -1.134 . . . . 25.0 112.451 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -84.59 160.94 20.34 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-N 119.005 1.403 . . . . 25.0 110.871 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 37.0 p -121.07 144.28 48.63 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 124.461 1.104 . . . . 25.0 111.202 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.47 -168.46 39.03 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.478 1.037 . . . . 25.0 112.559 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -115.17 143.21 45.58 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 125.183 1.393 . . . . 25.0 111.006 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.3 pt -145.22 154.79 54.35 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 125.278 1.431 . . . . 25.0 109.82 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.43 122.63 9.39 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.911 2.407 . . . . 25.0 111.361 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.0 t -58.86 -36.99 48.69 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-O 116.154 -1.879 . . . . 25.0 115.042 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -63.63 -17.74 61.25 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.539 2.159 . . . . 25.0 114.684 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.64 -3.92 46.37 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.088 0.858 . . . . 25.0 110.343 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.5 mt -118.84 158.44 25.65 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.491 1.516 . . . . 25.0 112.371 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.78 141.88 36.76 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.13 2.172 . . . . 25.0 108.837 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.9 141.64 59.5 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.697 2.265 . . . . 25.0 111.113 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 87.6 t -72.75 136.01 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.675 1.19 . . . . 25.0 108.19 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.135 2.574 . . . . 25.0 109.663 179.907 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.476 0.849 0 CA-C-O 120.969 0.414 . . . . 25.0 111.756 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.8 t -132.75 148.33 52.32 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.034 1.334 . . . . 25.0 110.109 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 58.0 mt -84.33 163.73 19.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.519 1.128 . . . . 25.0 109.407 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -131.95 157.1 44.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.112 1.365 . . . . 25.0 111.506 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -133.66 152.23 51.84 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.855 1.662 . . . . 25.0 110.142 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.76 133.1 37.13 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.741 1.616 . . . . 25.0 113.112 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.8 mt -94.46 -28.42 15.49 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.419 1.888 . . . . 25.0 112.391 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -146.58 155.22 42.32 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 124.757 1.223 . . . . 25.0 110.436 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -61.19 149.13 38.5 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.842 -0.799 . . . . 25.0 108.842 175.727 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -147.63 138.64 23.5 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 123.539 0.736 . . . . 25.0 109.996 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -116.97 137.67 52.07 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 107.731 -1.211 . . . . 25.0 107.731 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.3 130.59 46.89 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.309 1.044 . . . . 25.0 111.259 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -90.93 -26.19 19.41 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.48 1.112 . . . . 25.0 111.925 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.0 p -131.14 172.45 12.1 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.317 1.447 . . . . 25.0 110.437 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.64 -18.79 64.35 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.084 0.953 . . . . 25.0 112.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -94.86 -8.15 38.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.562 1.545 . . . . 25.0 112.3 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -94.27 156.67 16.41 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.332 1.053 . . . . 25.0 110.259 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 mt -112.11 141.43 45.79 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.83 1.252 . . . . 25.0 110.143 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.7 p -99.34 146.21 26.51 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.002 1.321 . . . . 25.0 108.126 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.23 175.68 13.13 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.801 0.81 . . . . 25.0 111.059 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -126.88 159.61 33.44 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.151 1.38 . . . . 25.0 108.532 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.19 134.31 44.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.609 1.164 . . . . 25.0 110.292 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.65 -11.27 62.9 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 125.234 1.397 . . . . 25.0 113.489 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -70.4 136.67 49.8 Favored 'General case' 0 C--N 1.347 0.483 0 CA-C-N 119.212 1.506 . . . . 25.0 109.452 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -101.67 150.05 23.51 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.84 0.829 . . . . 25.0 112.049 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -141.47 161.28 38.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.809 2.044 . . . . 25.0 111.295 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -121.51 137.87 54.54 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.459 2.303 . . . . 25.0 105.629 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -86.73 127.66 40.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 122.778 0.431 . . . . 25.0 110.603 -178.433 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.8 mt -97.47 -41.08 8.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.694 1.198 . . . . 25.0 109.85 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.0 130.85 9.15 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.917 0.887 . . . . 25.0 109.962 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.6 p -125.64 12.37 7.99 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.447 1.647 . . . . 25.0 115.447 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.4 p -95.11 0.22 54.08 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.866 1.267 . . . . 25.0 113.225 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -88.84 16.12 7.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.746 1.618 . . . . 25.0 113.433 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.86 -158.18 18.5 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 118.497 0.59 . . . . 25.0 112.869 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.64 -7.72 35.68 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.298 1.439 . . . . 25.0 112.19 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -111.57 123.08 49.5 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 105.691 -1.966 . . . . 25.0 105.691 177.86 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.29 157.0 21.48 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.221 1.193 . . . . 25.0 114.221 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.85 131.97 41.61 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.58 1.952 . . . . 25.0 106.283 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.9 m -139.19 167.76 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.538 1.161 . . . . 25.0 113.922 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -125.65 114.76 19.12 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.738 2.815 . . . . 25.0 104.919 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.8 t -74.99 121.92 22.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.463 -0.94 . . . . 25.0 108.463 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.73 -21.25 55.55 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.135 0.974 . . . . 25.0 111.418 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.0 m -88.21 -46.01 9.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.616 1.166 . . . . 25.0 112.179 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.1 p -93.89 -21.53 19.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.477 0.917 . . . . 25.0 113.477 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.45 0.62 87.39 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 118.337 -1.257 . . . . 25.0 112.558 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -90.36 166.9 13.03 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.037 1.419 . . . . 25.0 111.789 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 p -122.7 145.47 48.36 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.878 1.271 . . . . 25.0 110.513 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.67 -168.41 38.84 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.579 1.085 . . . . 25.0 112.117 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -116.27 137.32 52.24 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.974 1.31 . . . . 25.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.8 pt -144.92 155.29 55.66 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.915 1.286 . . . . 25.0 110.651 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.08 123.96 10.87 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.981 3.121 . . . . 25.0 112.941 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 p -59.46 -36.23 38.57 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-O 115.852 -2.023 . . . . 25.0 115.955 178.282 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.98 -18.73 63.0 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 123.322 2.222 . . . . 25.0 114.376 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -79.56 -3.77 48.4 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.906 0.775 . . . . 25.0 110.938 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.0 mt -119.54 158.2 26.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.087 1.355 . . . . 25.0 112.38 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -142.3 141.09 20.19 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 127.452 2.301 . . . . 25.0 107.967 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.23 146.16 89.89 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.581 2.187 . . . . 25.0 112.229 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.55 136.06 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.085 1.354 . . . . 25.0 108.397 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 . . . . . 0 C--O 1.251 1.148 0 C-N-CA 127.699 2.4 . . . . 25.0 109.577 179.808 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.925 0.393 . . . . 25.0 111.44 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.1 t -133.4 154.7 50.54 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.435 1.494 . . . . 25.0 109.879 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.7 mt -78.43 153.22 31.69 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.98 0.912 . . . . 25.0 110.15 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -130.34 150.16 51.7 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.907 1.683 . . . . 25.0 107.194 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -127.34 148.07 50.25 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.354 1.062 . . . . 25.0 110.693 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.41 132.49 37.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.192 1.397 . . . . 25.0 112.212 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.9 mt -89.5 -28.74 19.44 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.338 1.855 . . . . 25.0 112.301 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -151.65 158.71 43.82 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.861 1.264 . . . . 25.0 110.618 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -61.19 149.11 38.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.3 0.64 . . . . 25.0 109.863 176.103 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -147.06 135.11 21.47 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 123.907 0.883 . . . . 25.0 109.878 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -113.57 136.98 52.22 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.02 128.73 38.28 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.554 1.141 . . . . 25.0 111.083 -179.221 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -82.68 -25.83 32.65 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.789 1.236 . . . . 25.0 111.599 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -130.94 168.92 16.53 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.385 1.474 . . . . 25.0 109.98 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.04 -15.83 63.77 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.2 1.0 . . . . 25.0 112.825 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -101.31 -2.64 30.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.778 1.631 . . . . 25.0 113.018 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -94.84 156.79 16.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.562 1.145 . . . . 25.0 110.187 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 mt -97.43 136.24 38.16 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.738 1.215 . . . . 25.0 111.493 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.0 m -98.61 144.02 28.37 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -158.34 173.12 17.15 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.932 0.872 . . . . 25.0 111.438 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -126.43 159.17 34.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.329 1.452 . . . . 25.0 108.572 178.12 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.17 134.26 44.36 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.75 1.22 . . . . 25.0 110.208 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.33 -10.22 65.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.148 1.356 . . . . 25.0 113.462 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.13 138.07 51.61 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 119.255 1.527 . . . . 25.0 110.057 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -102.63 150.76 23.11 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.409 0.684 . . . . 25.0 111.764 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -138.05 159.49 41.89 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.132 1.373 . . . . 25.0 113.682 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -112.75 125.53 54.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.38 -2.822 . . . . 25.0 103.38 176.616 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 mm -85.43 122.53 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.398 -0.964 . . . . 25.0 108.398 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.4 mt -90.19 -41.94 11.32 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.051 0.94 . . . . 25.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.57 126.74 5.86 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.841 0.857 . . . . 25.0 109.882 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p -125.69 12.34 7.96 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 114.818 1.414 . . . . 25.0 114.818 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.0 p -93.52 -0.86 56.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.896 1.278 . . . . 25.0 113.364 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -89.58 14.22 12.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.4 1.48 . . . . 25.0 113.761 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.82 -157.88 18.58 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 118.621 0.646 . . . . 25.0 112.796 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -66.35 -6.85 15.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.807 1.643 . . . . 25.0 112.417 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.5 t-105 -109.25 113.49 26.37 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 106.412 -1.699 . . . . 25.0 106.412 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -107.86 153.97 22.25 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.587 0.958 . . . . 25.0 113.587 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -98.63 126.77 44.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.268 2.227 . . . . 25.0 105.162 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.1 m -141.35 170.67 13.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.265 1.031 . . . . 25.0 112.978 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -128.73 125.09 37.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 127.637 2.375 . . . . 25.0 108.079 176.553 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 t -77.7 122.63 25.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 106.753 -1.573 . . . . 25.0 106.753 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.8 mt -78.56 -16.72 57.11 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.597 0.759 . . . . 25.0 111.694 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.9 m -86.68 -43.23 12.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.572 1.149 . . . . 25.0 111.542 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -98.05 -21.8 16.6 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.438 0.903 . . . . 25.0 113.438 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.02 1.74 87.95 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-O 118.297 -1.28 . . . . 25.0 112.499 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -88.04 165.12 15.39 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 119.02 1.41 . . . . 25.0 111.729 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.7 p -122.22 149.14 44.08 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.026 1.331 . . . . 25.0 111.851 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.64 -168.6 39.15 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 125.338 1.447 . . . . 25.0 111.864 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -116.39 142.72 46.49 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.486 1.114 . . . . 25.0 109.966 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.7 pt -145.43 157.56 52.29 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 124.897 1.279 . . . . 25.0 110.659 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.99 124.37 10.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.793 2.995 . . . . 25.0 110.367 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.0 p -57.51 -35.93 40.21 Favored Pre-proline 0 CA--C 1.55 0.948 0 N-CA-C 117.174 2.287 . . . . 25.0 117.174 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.25 -16.0 52.65 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.819 2.346 . . . . 25.0 114.871 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -78.34 -5.41 52.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.094 -0.955 . . . . 25.0 112.103 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.4 mt -119.47 157.98 27.18 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 124.175 0.99 . . . . 25.0 111.433 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.53 138.14 17.12 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 126.653 1.981 . . . . 25.0 108.787 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.75 146.94 80.29 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.85 2.367 . . . . 25.0 111.568 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.47 136.02 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.686 1.194 . . . . 25.0 108.39 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.164 1.386 . . . . 25.0 108.66 -179.426 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 N--CA 1.475 0.792 0 CA-C-O 120.854 0.359 . . . . 25.0 110.729 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 t -153.76 162.63 41.07 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.314 1.446 . . . . 25.0 110.603 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.19 160.19 31.51 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -122.85 145.7 48.21 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 123.675 0.79 . . . . 25.0 109.713 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -123.82 151.42 43.4 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.629 1.572 . . . . 25.0 110.195 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.01 134.8 36.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.956 1.302 . . . . 25.0 113.236 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.54 -26.56 17.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.284 1.434 . . . . 25.0 111.599 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -147.71 156.35 42.67 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.978 1.311 . . . . 25.0 110.344 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.08 149.16 37.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.083 0.553 . . . . 25.0 109.782 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -148.16 137.9 22.38 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.226 1.01 . . . . 25.0 109.946 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -114.34 138.8 50.07 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.152 -1.425 . . . . 25.0 107.152 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.98 128.36 36.47 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.49 1.116 . . . . 25.0 111.076 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -85.94 -25.16 26.24 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.932 1.293 . . . . 25.0 112.087 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 43.9 p -130.48 170.83 13.71 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.018 1.327 . . . . 25.0 110.211 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -68.1 -17.31 64.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.151 0.98 . . . . 25.0 112.487 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.18 -3.12 27.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.645 1.578 . . . . 25.0 112.635 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.7 156.77 17.34 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.258 1.023 . . . . 25.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.7 mt -104.55 137.67 42.05 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.099 1.36 . . . . 25.0 111.442 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.7 m -96.73 145.75 25.51 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.158 1.383 . . . . 25.0 107.87 177.796 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -158.6 171.11 20.72 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 122.048 0.928 . . . . 25.0 111.859 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -123.09 159.71 27.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.048 1.739 . . . . 25.0 108.053 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.23 134.06 44.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.25 1.02 . . . . 25.0 109.829 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.6 -9.31 68.92 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.06 -1.411 . . . . 25.0 114.129 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -69.74 135.82 50.22 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 119.544 1.672 . . . . 25.0 110.108 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -99.78 151.07 21.67 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.579 0.752 . . . . 25.0 112.255 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -141.83 157.28 45.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.495 1.918 . . . . 25.0 111.675 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -116.14 134.6 54.76 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.695 1.998 . . . . 25.0 106.302 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.5 mm -82.47 126.64 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.645 0.778 . . . . 25.0 111.484 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -98.95 -42.85 6.94 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.585 1.154 . . . . 25.0 108.873 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.68 125.69 5.4 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 124.524 1.13 . . . . 25.0 109.177 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.3 p -125.68 12.47 7.97 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.317 1.599 . . . . 25.0 115.317 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.9 p -92.61 1.19 57.4 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.863 1.265 . . . . 25.0 113.42 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -90.22 16.13 9.15 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.618 1.567 . . . . 25.0 113.595 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.81 -157.9 18.58 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 118.705 0.684 . . . . 25.0 111.946 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.43 -5.43 19.17 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.069 1.348 . . . . 25.0 111.627 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -106.1 110.13 22.29 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.236 1.815 . . . . 25.0 106.358 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -107.68 149.49 28.06 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 113.362 0.875 . . . . 25.0 113.362 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -95.41 128.05 41.95 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.703 2.001 . . . . 25.0 105.719 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -141.74 170.5 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 122.23 1.014 . . . . 25.0 112.927 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -123.66 125.86 45.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 127.346 2.258 . . . . 25.0 106.38 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -76.71 119.66 20.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.492 -1.299 . . . . 25.0 107.492 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.4 mt -74.87 -18.72 60.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.541 0.736 . . . . 25.0 111.641 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.7 m -91.03 -44.5 9.27 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.395 1.078 . . . . 25.0 112.738 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.2 p -99.05 -21.39 16.23 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.29 1.219 . . . . 25.0 114.29 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.55 1.2 90.05 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.352 -1.249 . . . . 25.0 112.576 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.41 160.69 20.56 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.081 1.441 . . . . 25.0 110.943 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 p -120.2 144.31 47.79 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.315 1.046 . . . . 25.0 110.805 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.57 -168.34 38.79 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.519 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -114.93 141.58 47.76 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 125.159 1.384 . . . . 25.0 110.759 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 pt -144.17 150.56 49.16 Favored Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.27 1.428 . . . . 25.0 109.536 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.68 122.89 9.58 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.546 2.83 . . . . 25.0 111.647 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.8 p -59.35 -36.17 38.46 Favored Pre-proline 0 CA--C 1.548 0.893 0 CA-C-O 116.049 -1.929 . . . . 25.0 115.813 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -64.62 -18.59 63.23 Favored 'Trans proline' 0 C--N 1.362 1.248 0 CA-C-N 123.101 2.143 . . . . 25.0 114.624 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -79.32 -4.08 49.15 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.759 0.823 . . . . 25.0 111.0 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.5 mt -118.73 158.45 25.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.25 1.42 . . . . 25.0 112.907 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.79 144.79 43.17 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.572 2.349 . . . . 25.0 108.125 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.25 147.15 91.11 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.829 2.353 . . . . 25.0 111.573 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.57 136.0 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.899 1.28 . . . . 25.0 108.798 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 . . . . . 0 C--O 1.25 1.115 0 C-N-CA 127.398 2.279 . . . . 25.0 109.805 179.831 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.472 0.626 0 CA-C-O 119.211 -0.424 . . . . 25.0 109.958 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.0 t -144.56 152.26 40.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.148 1.379 . . . . 25.0 110.187 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 mt -83.63 163.32 20.4 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.372 1.069 . . . . 25.0 110.101 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -131.14 151.39 51.5 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.195 1.398 . . . . 25.0 109.716 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -126.2 153.03 45.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 25.0 110.363 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.81 131.14 35.37 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.362 1.465 . . . . 25.0 112.505 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.8 mt -89.43 -30.41 18.34 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.684 1.594 . . . . 25.0 111.523 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -153.06 163.9 38.99 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.232 1.813 . . . . 25.0 109.681 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.12 149.14 38.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.948 0.899 . . . . 25.0 111.458 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -145.19 137.09 25.6 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.128 1.371 . . . . 25.0 109.628 178.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -113.01 134.88 54.31 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.696 -1.224 . . . . 25.0 107.696 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.97 129.12 39.81 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.446 1.098 . . . . 25.0 109.964 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -93.76 -21.46 19.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.023 0.929 . . . . 25.0 112.567 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.8 p -129.86 171.1 13.08 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.884 1.274 . . . . 25.0 110.36 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.19 -18.36 63.91 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.033 0.933 . . . . 25.0 111.918 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -97.41 -3.64 39.79 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.88 1.672 . . . . 25.0 112.264 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -94.87 158.49 15.46 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.313 1.045 . . . . 25.0 111.296 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.5 mt -111.97 140.11 46.9 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.297 1.439 . . . . 25.0 109.998 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.4 m -95.85 145.8 25.07 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 107.582 -1.266 . . . . 25.0 107.582 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -155.24 169.45 24.14 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 122.021 0.915 . . . . 25.0 110.942 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -123.14 160.4 26.55 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.432 1.493 . . . . 25.0 108.228 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -54.31 134.14 45.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.76 1.224 . . . . 25.0 109.881 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.84 -11.28 68.12 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 125.115 1.34 . . . . 25.0 113.837 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -71.5 137.75 48.4 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 119.376 1.588 . . . . 25.0 110.064 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -106.75 153.27 22.69 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-O 121.781 0.801 . . . . 25.0 112.218 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -140.51 157.91 44.79 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.654 1.982 . . . . 25.0 112.532 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -113.85 136.16 53.17 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 105.105 -2.183 . . . . 25.0 105.105 177.006 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 46.5 mm -82.25 124.36 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.457 0.703 . . . . 25.0 111.199 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 47.9 mt -90.92 -44.03 9.62 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -159.87 129.92 5.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.507 1.123 . . . . 25.0 109.09 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.2 p -125.51 12.45 8.07 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 115.722 1.749 . . . . 25.0 115.722 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.6 p -95.18 5.32 52.12 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.65 1.18 . . . . 25.0 112.718 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -88.51 13.91 10.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.23 1.812 . . . . 25.0 113.788 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.62 -158.0 18.69 Favored Glycine 0 C--N 1.343 0.934 0 N-CA-C 111.633 -0.587 . . . . 25.0 111.633 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -67.85 -7.18 25.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.914 1.286 . . . . 25.0 111.365 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -107.6 116.14 31.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.984 2.114 . . . . 25.0 106.382 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -111.7 153.83 25.87 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.473 0.916 . . . . 25.0 113.473 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -97.28 130.49 44.46 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 126.879 2.072 . . . . 25.0 106.041 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.5 m -140.14 166.74 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 122.256 1.027 . . . . 25.0 113.678 -178.49 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 -125.37 122.82 37.89 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.309 2.244 . . . . 25.0 105.827 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.8 t -76.33 123.14 25.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.803 -0.814 . . . . 25.0 108.803 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.17 -19.43 58.46 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.847 0.859 . . . . 25.0 110.975 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.3 m -88.32 -45.92 9.62 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.165 1.386 . . . . 25.0 112.491 -179.224 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.8 p -97.63 -21.55 16.98 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.915 1.08 . . . . 25.0 113.915 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.33 1.81 88.69 Favored Glycine 0 CA--C 1.538 1.482 0 CA-C-O 118.419 -1.211 . . . . 25.0 112.608 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -87.54 167.18 14.17 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 118.974 1.387 . . . . 25.0 111.417 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 51.3 p -121.0 145.34 47.87 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.771 1.228 . . . . 25.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.56 -168.46 38.99 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.453 1.025 . . . . 25.0 112.646 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -117.19 142.93 46.42 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.914 1.286 . . . . 25.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.4 pt -146.23 150.56 41.84 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.807 1.243 . . . . 25.0 110.283 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.29 123.39 10.21 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.89 3.06 . . . . 25.0 111.464 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.5 p -58.97 -35.84 36.47 Favored Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 116.589 2.07 . . . . 25.0 116.589 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -64.84 -18.53 62.66 Favored 'Trans proline' 0 C--N 1.361 1.207 0 CA-C-N 123.277 2.206 . . . . 25.0 114.797 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.87 -4.18 48.36 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.04 0.836 . . . . 25.0 110.716 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.1 mt -119.82 159.25 24.94 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 125.749 1.62 . . . . 25.0 112.6 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.8 139.46 30.75 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.852 2.061 . . . . 25.0 107.98 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.28 142.52 73.48 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.541 2.161 . . . . 25.0 110.046 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.57 135.76 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.73 0.812 . . . . 25.0 108.945 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 . . . . . 0 C--O 1.252 1.2 0 C-N-CA 127.373 2.269 . . . . 25.0 111.748 179.576 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 119.174 -0.441 . . . . 25.0 111.952 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.4 t -132.44 151.06 52.03 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.812 1.245 . . . . 25.0 111.145 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.0 mt -83.64 164.49 19.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.968 1.307 . . . . 25.0 108.723 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -131.29 148.39 52.68 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.33 1.052 . . . . 25.0 109.979 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -125.58 155.54 40.53 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.077 1.351 . . . . 25.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.01 133.55 37.96 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.329 1.452 . . . . 25.0 113.624 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.08 -29.34 18.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.265 1.826 . . . . 25.0 112.071 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -152.04 161.5 42.53 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 125.723 1.609 . . . . 25.0 110.093 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -61.04 149.22 37.63 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.984 0.514 . . . . 25.0 109.795 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -145.51 138.58 26.2 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.179 0.991 . . . . 25.0 110.308 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -117.15 135.28 53.88 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.181 -1.414 . . . . 25.0 107.181 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.46 131.18 49.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.077 1.351 . . . . 25.0 111.65 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.2 mtp-105 -83.2 -29.36 28.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 25.0 111.628 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.3 p -131.61 173.62 10.94 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.202 1.401 . . . . 25.0 111.418 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -68.04 -18.65 64.75 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.107 1.363 . . . . 25.0 112.705 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -97.3 -6.33 34.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.463 1.505 . . . . 25.0 112.421 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -95.3 155.95 16.52 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.876 1.27 . . . . 25.0 109.305 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.0 mt -109.95 143.41 39.95 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 124.487 1.115 . . . . 25.0 110.796 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 70.1 m -96.8 147.8 23.56 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.11 1.364 . . . . 25.0 108.116 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -156.07 170.0 23.2 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.755 0.788 . . . . 25.0 111.226 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -120.7 157.24 30.07 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.263 1.425 . . . . 25.0 108.488 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -54.23 134.18 44.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.845 1.258 . . . . 25.0 110.4 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.62 -8.48 68.69 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 125.25 1.405 . . . . 25.0 113.752 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -70.34 133.14 46.65 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 119.168 1.484 . . . . 25.0 110.681 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -97.79 152.69 18.89 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 123.778 0.831 . . . . 25.0 110.971 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -140.29 154.51 46.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.536 1.534 . . . . 25.0 111.564 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -110.14 130.04 55.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 104.53 -2.396 . . . . 25.0 104.53 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -82.9 125.4 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 123.148 0.579 . . . . 25.0 111.009 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.1 mt -95.27 -41.85 8.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.606 1.162 . . . . 25.0 109.341 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -158.58 129.09 6.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.566 1.146 . . . . 25.0 109.401 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 79.8 p -125.6 12.38 8.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.491 1.664 . . . . 25.0 115.491 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.6 p -94.19 2.44 55.93 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.684 1.193 . . . . 25.0 113.298 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -88.57 14.56 9.64 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.689 1.596 . . . . 25.0 114.036 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.67 -158.02 18.66 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 118.533 0.606 . . . . 25.0 112.706 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.4 -2.9 9.5 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.641 1.576 . . . . 25.0 112.258 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.4 t-105 -117.43 120.2 37.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 105.573 -2.01 . . . . 25.0 105.573 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.16 157.54 20.73 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 114.695 1.368 . . . . 25.0 114.695 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -96.97 125.24 41.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.353 2.261 . . . . 25.0 105.346 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.43 171.53 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 122.148 0.975 . . . . 25.0 112.786 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -122.51 125.74 46.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.393 2.277 . . . . 25.0 108.012 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -77.87 119.16 20.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.245 -1.761 . . . . 25.0 106.245 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.86 -17.44 59.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.737 0.815 . . . . 25.0 112.057 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.5 m -84.08 -44.47 14.04 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.747 1.219 . . . . 25.0 112.217 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -100.61 -19.33 16.16 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.023 1.12 . . . . 25.0 114.023 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.12 1.86 88.29 Favored Glycine 0 CA--C 1.539 1.536 0 CA-C-O 118.608 -1.107 . . . . 25.0 112.164 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -83.06 167.15 18.14 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 118.776 1.288 . . . . 25.0 111.153 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 38.3 p -125.05 147.85 48.78 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.707 1.203 . . . . 25.0 110.462 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.82 -168.55 38.97 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.49 1.043 . . . . 25.0 112.044 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -120.12 140.35 51.21 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.418 1.087 . . . . 25.0 110.338 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.0 pt -147.24 156.6 46.41 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.176 1.39 . . . . 25.0 110.793 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.16 123.13 9.98 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.903 3.069 . . . . 25.0 112.755 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 p -59.94 -35.47 28.92 Favored Pre-proline 0 CA--C 1.551 1.016 0 CA-C-O 115.785 -2.055 . . . . 25.0 115.509 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.3 -18.98 65.15 Favored 'Trans proline' 0 C--N 1.363 1.312 0 CA-C-N 123.488 2.281 . . . . 25.0 114.245 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -79.12 -3.12 43.89 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 119.064 0.847 . . . . 25.0 110.335 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 46.2 mt -119.13 158.18 26.43 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.831 1.653 . . . . 25.0 111.494 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.41 142.74 35.89 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.133 2.173 . . . . 25.0 108.478 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.61 145.95 92.06 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.738 2.292 . . . . 25.0 111.03 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.9 t -72.42 135.85 26.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.115 0.966 . . . . 25.0 108.468 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 127.223 2.209 . . . . 25.0 109.665 -179.906 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 t . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 120.711 0.291 . . . . 25.0 111.287 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.0 t -126.98 147.77 50.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.224 1.41 . . . . 25.0 109.345 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.5 mt -86.9 162.87 17.48 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.214 1.006 . . . . 25.0 111.361 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -134.63 148.21 50.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.382 1.873 . . . . 25.0 107.671 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -127.46 153.38 46.36 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.628 0.771 . . . . 25.0 111.655 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.57 132.76 42.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.051 1.74 . . . . 25.0 112.495 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -91.8 -28.75 17.16 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.976 1.71 . . . . 25.0 111.887 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -150.86 160.15 44.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.734 1.614 . . . . 25.0 109.652 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -61.04 149.17 37.79 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.717 -0.475 . . . . 25.0 109.717 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -146.55 135.72 22.66 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 124.179 0.991 . . . . 25.0 108.927 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -114.54 139.32 49.68 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.6 126.83 29.15 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.564 1.145 . . . . 25.0 110.558 -179.311 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -86.46 -24.26 25.69 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.742 1.217 . . . . 25.0 111.727 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -129.3 170.11 14.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.454 1.502 . . . . 25.0 109.977 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.78 -16.83 64.31 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.462 1.105 . . . . 25.0 113.02 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.74 -2.45 28.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.572 1.549 . . . . 25.0 113.105 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -91.73 157.98 16.62 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.08 0.952 . . . . 25.0 110.657 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.24 138.05 39.68 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.27 1.428 . . . . 25.0 111.225 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -99.43 142.88 30.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.154 1.382 . . . . 25.0 107.459 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -159.93 173.83 15.32 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.551 0.691 . . . . 25.0 111.942 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -126.01 159.87 31.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.333 1.453 . . . . 25.0 110.374 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -54.19 134.35 44.53 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.321 1.848 . . . . 25.0 110.993 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.12 -11.27 69.46 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.348 1.452 . . . . 25.0 114.107 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -74.2 137.77 43.31 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 118.88 1.34 . . . . 25.0 109.998 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -100.2 153.58 19.15 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.735 0.814 . . . . 25.0 111.245 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -140.01 153.02 46.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.652 1.581 . . . . 25.0 112.238 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -105.35 131.26 53.02 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.643 1.977 . . . . 25.0 105.75 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.38 123.17 38.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.101 -0.703 . . . . 25.0 109.101 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -93.03 -44.62 8.31 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.873 0.869 . . . . 25.0 109.737 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.05 130.04 8.6 Favored 'General case' 0 C--N 1.346 0.418 0 C-N-CA 123.652 0.781 . . . . 25.0 110.074 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.9 p -125.59 12.32 8.01 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.158 1.383 . . . . 25.0 114.584 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.1 p -93.9 -2.3 53.52 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.896 1.278 . . . . 25.0 113.04 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -86.19 15.53 5.12 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.518 1.527 . . . . 25.0 112.922 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.78 -158.19 18.56 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-O 121.506 0.503 . . . . 25.0 112.362 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -66.16 -12.14 53.93 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.488 1.515 . . . . 25.0 111.719 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.7 t-105 -101.57 114.61 28.79 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.374 1.869 . . . . 25.0 106.25 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -105.75 150.64 25.33 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 113.403 0.89 . . . . 25.0 113.403 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -96.87 129.38 44.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.541 1.936 . . . . 25.0 105.936 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.41 168.96 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 121.962 0.887 . . . . 25.0 112.671 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -125.88 128.67 47.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.033 2.133 . . . . 25.0 106.922 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 t -78.66 125.03 28.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.371 -0.974 . . . . 25.0 108.371 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.03 -17.15 61.47 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.352 0.661 . . . . 25.0 111.012 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 86.3 m -90.95 -46.21 8.3 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.09 1.356 . . . . 25.0 112.971 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.5 p -100.4 -21.97 15.21 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.514 1.301 . . . . 25.0 114.514 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.35 1.39 85.98 Favored Glycine 0 CA--C 1.537 1.455 0 CA-C-O 118.713 -1.048 . . . . 25.0 112.364 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -81.32 157.93 24.91 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 118.726 1.263 . . . . 25.0 110.727 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.8 p -119.65 144.89 46.92 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.129 0.972 . . . . 25.0 110.286 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.6 -168.37 38.82 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.212 1.387 . . . . 25.0 111.091 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -115.16 140.28 49.21 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.857 0.863 . . . . 25.0 110.706 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.7 pt -141.01 153.22 66.97 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.107 1.363 . . . . 25.0 109.743 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.35 122.89 9.69 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.359 2.706 . . . . 25.0 112.007 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 p -59.74 -36.6 41.17 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 116.11 -1.9 . . . . 25.0 115.205 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.08 -18.56 62.05 Favored 'Trans proline' 0 C--N 1.362 1.248 0 C-N-CA 122.627 2.218 . . . . 25.0 114.659 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.6 -2.31 38.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.205 1.002 . . . . 25.0 110.784 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.1 mt -118.19 158.48 25.03 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.035 1.334 . . . . 25.0 112.753 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.43 138.02 23.72 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.822 2.049 . . . . 25.0 108.304 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.68 138.36 49.07 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.955 2.436 . . . . 25.0 112.17 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.7 t -72.91 136.17 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.646 1.578 . . . . 25.0 108.076 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.253 1.259 0 CA-C-O 117.851 -1.071 . . . . 25.0 110.246 179.881 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.298 -0.26 . . . . 25.0 110.298 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.1 t -142.73 154.23 44.07 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.209 1.404 . . . . 25.0 110.243 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt -81.73 169.08 17.38 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.343 1.057 . . . . 25.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -130.4 146.48 51.97 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.551 1.541 . . . . 25.0 108.408 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -123.32 152.31 41.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.452 1.101 . . . . 25.0 110.937 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.15 134.89 37.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.824 1.65 . . . . 25.0 112.951 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.3 mt -89.6 -29.06 19.11 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.18 1.792 . . . . 25.0 111.909 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -153.8 162.75 40.97 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 125.752 1.621 . . . . 25.0 110.167 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.19 149.26 38.1 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.526 0.73 . . . . 25.0 109.93 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -146.79 135.82 22.47 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.979 0.912 . . . . 25.0 109.277 178.36 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -110.08 136.58 49.1 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.52 127.05 29.6 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.95 0.9 . . . . 25.0 109.534 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 -87.71 -22.23 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.075 0.95 . . . . 25.0 111.698 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -134.08 171.74 13.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.583 1.553 . . . . 25.0 110.214 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -69.03 -17.37 63.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.994 0.918 . . . . 25.0 111.903 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -96.66 -6.17 37.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.92 1.688 . . . . 25.0 112.444 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -94.83 157.86 15.74 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.564 1.146 . . . . 25.0 110.542 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 mt -106.92 139.85 40.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.229 1.412 . . . . 25.0 110.856 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.6 m -97.64 143.38 28.37 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -159.31 173.82 15.71 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.675 0.75 . . . . 25.0 111.382 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -124.3 158.98 31.28 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.362 1.465 . . . . 25.0 109.436 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.31 44.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 25.0 110.849 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.26 -9.27 72.28 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 125.157 1.361 . . . . 25.0 113.797 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.44 135.57 48.81 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.038 1.419 . . . . 25.0 109.631 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -99.75 151.8 20.83 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 121.559 0.695 . . . . 25.0 111.599 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -139.78 157.0 46.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.685 1.594 . . . . 25.0 112.832 -177.825 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -105.9 130.45 53.86 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 127.014 2.126 . . . . 25.0 105.439 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.8 mm -82.94 121.21 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.5 mt -92.79 -43.16 9.16 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.989 0.915 . . . . 25.0 108.741 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.95 128.47 6.3 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 124.018 0.927 . . . . 25.0 109.516 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 82.4 p -125.61 12.4 8.01 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.407 1.632 . . . . 25.0 115.407 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -97.44 0.71 48.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.995 1.318 . . . . 25.0 114.243 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -88.16 15.98 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.205 1.402 . . . . 25.0 113.671 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.65 -157.89 18.69 Favored Glycine 0 C--N 1.344 1.027 0 N-CA-C 111.255 -0.738 . . . . 25.0 111.255 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.21 -7.26 28.76 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.351 1.06 . . . . 25.0 111.503 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.2 t-105 -103.12 111.64 24.1 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.26 1.824 . . . . 25.0 106.447 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -111.01 153.17 25.96 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.702 0.801 . . . . 25.0 112.736 -178.65 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -99.09 128.39 45.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.631 1.972 . . . . 25.0 106.178 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.5 m -142.86 169.73 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.079 0.942 . . . . 25.0 112.887 -179.19 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -124.85 126.9 46.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.247 2.219 . . . . 25.0 108.305 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.8 t -78.13 121.69 24.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.022 -1.473 . . . . 25.0 107.022 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.2 mt -78.54 -16.66 57.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.466 0.706 . . . . 25.0 111.19 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -88.67 -45.06 10.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.777 1.231 . . . . 25.0 111.725 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.6 p -95.82 -21.83 17.86 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.336 0.865 . . . . 25.0 113.336 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.07 1.04 89.77 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.085 -1.397 . . . . 25.0 112.832 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -89.85 164.55 14.57 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 119.342 1.571 . . . . 25.0 111.945 -178.764 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.6 p -120.48 147.76 44.71 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 125.071 1.348 . . . . 25.0 111.37 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.54 -168.42 38.93 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.948 1.261 . . . . 25.0 111.9 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -115.24 140.52 49.03 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.323 1.049 . . . . 25.0 110.299 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.0 pt -143.41 149.1 46.58 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.657 1.183 . . . . 25.0 109.236 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -68.7 124.43 11.51 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.867 3.045 . . . . 25.0 111.646 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.6 p -58.08 -35.45 33.95 Favored Pre-proline 0 CA--C 1.549 0.942 0 CA-C-O 115.719 -2.086 . . . . 25.0 116.392 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -64.31 -18.34 62.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 CA-C-N 123.394 2.248 . . . . 25.0 114.044 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.43 -3.63 47.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.742 0.817 . . . . 25.0 110.255 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.2 mt -119.78 158.83 25.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.94 1.696 . . . . 25.0 112.252 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.6 136.96 16.94 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.231 2.213 . . . . 25.0 107.275 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.73 145.85 87.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.735 2.29 . . . . 25.0 111.83 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.2 t -72.57 135.93 26.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 107.466 -1.309 . . . . 25.0 107.466 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 C--O 1.251 1.168 0 C-N-CA 127.369 2.267 . . . . 25.0 109.438 -179.714 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 119.327 -0.368 . . . . 25.0 110.098 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.3 t -143.66 151.98 40.78 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.94 1.296 . . . . 25.0 110.791 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.0 mt -82.08 166.2 19.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.525 1.13 . . . . 25.0 109.325 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -130.39 148.01 52.16 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.821 1.248 . . . . 25.0 109.154 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -126.25 156.07 40.88 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.616 1.166 . . . . 25.0 111.157 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.81 134.36 36.99 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.394 1.478 . . . . 25.0 112.68 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -87.77 -29.36 21.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.632 1.573 . . . . 25.0 112.143 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -154.69 165.79 35.45 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 126.099 1.759 . . . . 25.0 109.92 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.28 149.18 38.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.728 0.811 . . . . 25.0 110.654 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -149.58 135.92 19.1 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.543 1.137 . . . . 25.0 109.308 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -113.12 137.45 51.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.411 -1.7 . . . . 25.0 106.411 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.89 127.66 33.33 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.039 0.936 . . . . 25.0 111.019 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.0 mtp-105 -88.42 -22.93 23.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.334 1.453 . . . . 25.0 111.728 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.2 p -133.1 170.13 15.84 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 25.0 109.814 179.085 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.6 -18.6 63.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.364 0.666 . . . . 25.0 111.861 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -95.17 -6.55 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.735 1.614 . . . . 25.0 112.096 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -90.66 151.42 21.28 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.809 0.843 . . . . 25.0 110.75 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.3 mt -100.67 134.46 43.59 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.251 1.42 . . . . 25.0 109.222 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.9 m -91.65 142.78 27.24 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.936 -1.505 . . . . 25.0 106.936 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -154.15 168.04 27.84 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 121.654 0.74 . . . . 25.0 111.845 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -125.06 157.81 35.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.175 1.39 . . . . 25.0 108.755 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.18 134.15 44.44 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.355 1.062 . . . . 25.0 110.306 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.26 -8.87 69.72 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-O 118.302 -1.277 . . . . 25.0 113.732 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -69.93 132.22 45.63 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 119.147 1.474 . . . . 25.0 110.388 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -97.9 152.06 19.61 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.025 0.93 . . . . 25.0 110.556 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -140.68 155.4 46.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.736 1.214 . . . . 25.0 112.615 -178.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -106.01 130.19 53.98 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.16 122.3 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 123.368 0.667 . . . . 25.0 109.962 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.8 mt -99.58 -44.35 6.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.001 0.92 . . . . 25.0 110.06 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.45 128.46 7.39 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.702 0.801 . . . . 25.0 110.824 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.7 m -125.7 12.54 7.97 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.057 1.343 . . . . 25.0 113.549 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.2 p -93.38 -2.69 54.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.101 0.961 . . . . 25.0 113.525 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -87.82 15.69 6.75 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.385 1.474 . . . . 25.0 113.415 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.94 18.63 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 118.526 0.603 . . . . 25.0 111.964 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -67.26 -9.6 42.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.902 1.281 . . . . 25.0 111.411 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -100.01 107.54 19.5 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 105.948 -1.871 . . . . 25.0 105.948 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m0 -105.13 151.78 23.61 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -98.67 128.03 44.8 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.225 -1.769 . . . . 25.0 106.225 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.6 m -141.62 168.81 14.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.574 0.75 . . . . 25.0 111.085 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.3 ttt-85 -117.73 123.77 46.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.875 -1.528 . . . . 25.0 106.875 177.023 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.5 t -75.62 116.39 16.29 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 105.941 -1.874 . . . . 25.0 105.941 178.657 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -77.66 -16.88 58.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.825 0.85 . . . . 25.0 111.536 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -87.87 -46.69 9.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 25.0 111.826 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.8 p -93.5 -20.71 20.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.45 0.907 . . . . 25.0 113.45 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.26 4.38 90.48 Favored Glycine 0 CA--C 1.538 1.489 0 CA-C-O 118.471 -1.183 . . . . 25.0 112.254 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.89 167.15 13.05 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 119.016 1.408 . . . . 25.0 111.688 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.4 p -121.76 145.12 48.36 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.297 1.439 . . . . 25.0 109.125 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.68 -168.31 38.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.85 0.738 . . . . 25.0 112.633 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -120.16 141.41 49.89 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.874 1.27 . . . . 25.0 111.032 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 pt -146.41 152.86 47.02 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.914 1.285 . . . . 25.0 110.087 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.51 123.47 10.54 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.435 2.756 . . . . 25.0 111.303 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.1 p -58.24 -35.7 36.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 CA-C-O 115.921 -1.99 . . . . 25.0 116.235 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.37 -18.43 63.09 Favored 'Trans proline' 0 C--N 1.361 1.208 0 CA-C-N 123.184 2.173 . . . . 25.0 114.432 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.15 -3.6 46.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.003 0.82 . . . . 25.0 110.702 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.6 mt -118.83 158.43 25.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.813 1.645 . . . . 25.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.29 138.13 26.3 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 127.036 2.134 . . . . 25.0 108.295 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.71 141.24 53.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.731 2.287 . . . . 25.0 111.913 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.75 135.89 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 107.288 -1.375 . . . . 25.0 107.288 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 126.124 1.77 . . . . 25.0 110.352 179.89 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 119.046 -0.502 . . . . 25.0 109.887 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -147.49 156.43 42.84 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.978 1.311 . . . . 25.0 110.814 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt -82.23 157.37 23.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.151 0.981 . . . . 25.0 108.824 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -130.38 148.99 52.26 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.734 1.214 . . . . 25.0 109.924 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.12 155.53 35.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.156 1.382 . . . . 25.0 110.127 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.88 130.78 35.22 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.872 1.269 . . . . 25.0 112.697 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.2 mt -89.34 -30.12 18.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 25.0 111.293 178.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -148.45 157.11 43.26 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 125.39 1.476 . . . . 25.0 110.152 -178.86 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -61.04 149.27 37.49 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.27 0.628 . . . . 25.0 110.288 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -144.3 137.31 27.11 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.72 1.208 . . . . 25.0 110.149 178.471 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -114.56 135.31 54.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.995 -1.484 . . . . 25.0 106.995 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.82 128.96 39.1 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.324 1.05 . . . . 25.0 111.314 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -83.87 -29.01 27.56 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.419 1.488 . . . . 25.0 112.038 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 p -132.12 171.66 13.36 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.205 1.402 . . . . 25.0 110.542 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.75 -17.21 64.01 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.019 0.927 . . . . 25.0 111.833 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -95.08 -5.13 45.0 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.149 1.78 . . . . 25.0 112.301 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -97.31 156.56 16.39 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.272 1.029 . . . . 25.0 111.479 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.3 mt -104.44 136.76 43.41 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.562 1.545 . . . . 25.0 110.659 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.6 m -95.02 145.47 24.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -154.67 169.53 23.67 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.822 0.82 . . . . 25.0 111.636 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -125.43 158.43 34.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.392 1.477 . . . . 25.0 108.932 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -54.3 134.21 45.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.763 1.225 . . . . 25.0 110.0 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.59 -11.52 68.37 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 125.06 1.314 . . . . 25.0 113.552 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.83 134.16 47.11 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 119.194 1.497 . . . . 25.0 110.032 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -100.95 154.02 19.03 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.562 0.745 . . . . 25.0 111.243 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -140.39 154.93 46.88 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.956 1.302 . . . . 25.0 113.737 -177.567 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -107.11 129.23 54.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 104.049 -2.575 . . . . 25.0 104.049 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.7 mm -81.36 121.11 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 123.197 0.599 . . . . 25.0 109.913 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -93.04 -42.5 9.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.229 1.012 . . . . 25.0 109.205 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.06 126.87 6.22 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.985 0.914 . . . . 25.0 109.913 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.4 p -125.74 12.4 7.93 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.797 1.406 . . . . 25.0 114.797 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.0 p -96.47 -2.16 45.88 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.246 1.419 . . . . 25.0 114.391 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.53 16.31 6.75 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.13 1.372 . . . . 25.0 113.952 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.95 18.63 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 118.75 0.705 . . . . 25.0 112.831 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -67.86 -0.21 4.02 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.734 1.614 . . . . 25.0 112.071 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.6 t-105 -115.92 112.21 21.55 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.834 2.053 . . . . 25.0 106.166 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -110.11 154.12 23.74 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.013 0.925 . . . . 25.0 113.069 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -98.43 127.43 44.36 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 105.426 -2.065 . . . . 25.0 105.426 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.8 m -141.09 168.78 15.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.715 0.769 . . . . 25.0 111.694 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -121.42 123.2 41.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.565 1.546 . . . . 25.0 107.913 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.4 t -74.42 118.34 17.27 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.174 -2.158 . . . . 25.0 105.174 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.45 -12.45 60.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.521 0.728 . . . . 25.0 112.086 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.0 m -88.62 -43.83 11.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.897 1.279 . . . . 25.0 111.567 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 p -98.93 -21.05 16.46 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.987 1.106 . . . . 25.0 113.987 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.14 3.4 89.6 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 118.454 -1.192 . . . . 25.0 112.441 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -85.71 161.48 19.18 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.051 1.425 . . . . 25.0 111.354 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.0 p -120.6 145.32 47.5 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.873 1.269 . . . . 25.0 110.623 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.53 -168.25 38.67 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 124.541 1.067 . . . . 25.0 112.383 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.98 149.24 35.61 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.208 1.403 . . . . 25.0 111.746 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.0 pt -150.04 157.69 37.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.253 1.421 . . . . 25.0 111.003 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -71.26 122.13 8.42 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.978 2.452 . . . . 25.0 108.593 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.4 p -58.39 -35.19 30.59 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 116.953 2.205 . . . . 25.0 116.953 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -63.85 -16.21 53.51 Favored 'Trans proline' 0 C--N 1.36 1.184 0 C-N-CA 122.755 2.303 . . . . 25.0 115.199 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -77.83 -5.21 50.1 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.332 0.969 . . . . 25.0 111.817 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 33.0 mt -119.33 158.46 26.05 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.515 1.126 . . . . 25.0 112.274 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.25 143.26 32.84 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 127.596 2.358 . . . . 25.0 108.428 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -62.44 146.59 95.6 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.809 2.34 . . . . 25.0 111.272 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.46 135.85 26.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 123.971 0.909 . . . . 25.0 109.919 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.25 1.124 0 C-N-CA 127.174 2.189 . . . . 25.0 110.604 179.582 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.8 mt . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 108.592 -0.892 . . . . 25.0 108.592 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -130.16 147.97 51.95 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.247 1.019 . . . . 25.0 109.366 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -121.5 152.65 38.93 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.092 1.357 . . . . 25.0 110.705 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.89 135.57 35.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.201 1.4 . . . . 25.0 113.366 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 86.1 mt -98.47 -24.56 15.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.064 1.745 . . . . 25.0 112.242 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.03 153.04 38.43 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.557 1.143 . . . . 25.0 110.527 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.1 149.22 37.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 109.332 -0.618 . . . . 25.0 109.332 175.686 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -146.61 137.23 23.93 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.719 0.807 . . . . 25.0 109.592 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -112.89 136.87 52.06 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 106.972 -1.492 . . . . 25.0 106.972 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.39 127.92 34.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.261 1.025 . . . . 25.0 110.068 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -93.59 -20.42 20.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.422 1.089 . . . . 25.0 112.338 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.0 p -130.07 171.27 13.0 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.027 1.331 . . . . 25.0 110.119 179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.06 -18.97 64.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.248 1.019 . . . . 25.0 112.366 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -101.96 -2.93 28.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.771 1.628 . . . . 25.0 112.815 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.0 156.06 18.24 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.28 0.945 . . . . 25.0 110.87 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 mt -107.22 140.47 40.04 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.314 1.446 . . . . 25.0 110.787 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.5 m -97.5 145.07 26.58 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.674 1.19 . . . . 25.0 107.834 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -156.82 170.81 21.62 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.714 0.769 . . . . 25.0 111.074 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -122.87 156.81 33.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.337 1.455 . . . . 25.0 108.727 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.21 44.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.702 1.201 . . . . 25.0 110.198 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.45 -9.54 66.93 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.343 1.449 . . . . 25.0 113.38 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.34 133.97 46.38 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.066 1.433 . . . . 25.0 110.19 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -102.05 152.62 20.76 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.69 0.796 . . . . 25.0 110.616 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.3 156.23 48.5 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.292 1.437 . . . . 25.0 112.822 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -107.45 128.98 54.97 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 104.648 -2.353 . . . . 25.0 104.648 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.5 mm -82.07 123.0 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.511 0.725 . . . . 25.0 110.995 -177.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.0 mt -91.45 -44.48 9.09 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.171 -1.048 . . . . 25.0 108.171 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -158.83 127.46 5.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.408 1.083 . . . . 25.0 108.948 178.314 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.2 p -125.62 12.5 8.01 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.6 p -93.28 5.32 51.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.524 1.13 . . . . 25.0 112.773 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -91.15 12.43 20.05 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.846 1.658 . . . . 25.0 114.711 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.66 -157.81 18.7 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 118.651 0.66 . . . . 25.0 111.529 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -69.47 -1.12 7.7 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.883 1.273 . . . . 25.0 111.717 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -112.15 105.74 14.17 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.52 1.928 . . . . 25.0 106.456 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -105.38 151.08 24.64 Favored 'General case' 0 C--N 1.345 0.385 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -96.02 126.37 41.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.472 -2.048 . . . . 25.0 105.472 177.818 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.1 m -142.86 168.28 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.933 0.873 . . . . 25.0 112.605 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -121.35 127.62 51.45 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.522 1.929 . . . . 25.0 107.738 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.7 t -76.54 119.66 20.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 106.788 -1.56 . . . . 25.0 106.788 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.4 mt -76.74 -15.9 59.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.334 0.654 . . . . 25.0 111.207 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.6 m -87.59 -46.08 9.86 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.146 1.378 . . . . 25.0 112.265 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.9 p -101.19 -21.05 15.03 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.472 1.286 . . . . 25.0 114.472 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.76 2.34 90.5 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.558 -1.134 . . . . 25.0 112.451 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -84.59 160.94 20.34 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-N 119.005 1.403 . . . . 25.0 110.871 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 37.0 p -121.07 144.28 48.63 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 124.461 1.104 . . . . 25.0 111.202 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.47 -168.46 39.03 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.478 1.037 . . . . 25.0 112.559 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -115.17 143.21 45.58 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 125.183 1.393 . . . . 25.0 111.006 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.3 pt -145.22 154.79 54.35 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 125.278 1.431 . . . . 25.0 109.82 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.43 122.63 9.39 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.911 2.407 . . . . 25.0 111.361 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.0 t -58.86 -36.99 48.69 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-O 116.154 -1.879 . . . . 25.0 115.042 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -63.63 -17.74 61.25 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.539 2.159 . . . . 25.0 114.684 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.64 -3.92 46.37 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.088 0.858 . . . . 25.0 110.343 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.5 mt -118.84 158.44 25.65 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.491 1.516 . . . . 25.0 112.371 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.78 141.88 36.76 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.13 2.172 . . . . 25.0 108.837 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.9 141.64 59.5 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.697 2.265 . . . . 25.0 111.113 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 87.6 t . . . . . 0 CA--C 1.535 0.375 0 C-N-CA 124.675 1.19 . . . . 25.0 108.19 179.154 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 58.0 mt . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.407 -0.59 . . . . 25.0 109.407 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -131.95 157.1 44.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.112 1.365 . . . . 25.0 111.506 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -133.66 152.23 51.84 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.855 1.662 . . . . 25.0 110.142 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.76 133.1 37.13 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.741 1.616 . . . . 25.0 113.112 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.8 mt -94.46 -28.42 15.49 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.419 1.888 . . . . 25.0 112.391 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -146.58 155.22 42.32 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 124.757 1.223 . . . . 25.0 110.436 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -61.19 149.13 38.5 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.842 -0.799 . . . . 25.0 108.842 175.727 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -147.63 138.64 23.5 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 123.539 0.736 . . . . 25.0 109.996 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -116.97 137.67 52.07 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 107.731 -1.211 . . . . 25.0 107.731 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.3 130.59 46.89 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.309 1.044 . . . . 25.0 111.259 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -90.93 -26.19 19.41 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.48 1.112 . . . . 25.0 111.925 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.0 p -131.14 172.45 12.1 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.317 1.447 . . . . 25.0 110.437 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.64 -18.79 64.35 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.084 0.953 . . . . 25.0 112.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -94.86 -8.15 38.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.562 1.545 . . . . 25.0 112.3 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -94.27 156.67 16.41 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.332 1.053 . . . . 25.0 110.259 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 mt -112.11 141.43 45.79 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.83 1.252 . . . . 25.0 110.143 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.7 p -99.34 146.21 26.51 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.002 1.321 . . . . 25.0 108.126 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.23 175.68 13.13 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.801 0.81 . . . . 25.0 111.059 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -126.88 159.61 33.44 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.151 1.38 . . . . 25.0 108.532 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.19 134.31 44.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.609 1.164 . . . . 25.0 110.292 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.65 -11.27 62.9 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 125.234 1.397 . . . . 25.0 113.489 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -70.4 136.67 49.8 Favored 'General case' 0 C--N 1.347 0.483 0 CA-C-N 119.212 1.506 . . . . 25.0 109.452 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -101.67 150.05 23.51 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.84 0.829 . . . . 25.0 112.049 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -141.47 161.28 38.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.809 2.044 . . . . 25.0 111.295 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -121.51 137.87 54.54 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.459 2.303 . . . . 25.0 105.629 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -86.73 127.66 40.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 122.778 0.431 . . . . 25.0 110.603 -178.433 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.8 mt -97.47 -41.08 8.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.694 1.198 . . . . 25.0 109.85 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -156.0 130.85 9.15 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.917 0.887 . . . . 25.0 109.962 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.6 p -125.64 12.37 7.99 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.447 1.647 . . . . 25.0 115.447 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.4 p -95.11 0.22 54.08 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.866 1.267 . . . . 25.0 113.225 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -88.84 16.12 7.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.746 1.618 . . . . 25.0 113.433 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.86 -158.18 18.5 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 118.497 0.59 . . . . 25.0 112.869 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.64 -7.72 35.68 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.298 1.439 . . . . 25.0 112.19 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -111.57 123.08 49.5 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 105.691 -1.966 . . . . 25.0 105.691 177.86 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.29 157.0 21.48 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.221 1.193 . . . . 25.0 114.221 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.85 131.97 41.61 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.58 1.952 . . . . 25.0 106.283 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.9 m -139.19 167.76 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.538 1.161 . . . . 25.0 113.922 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -125.65 114.76 19.12 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.738 2.815 . . . . 25.0 104.919 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.8 t -74.99 121.92 22.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.463 -0.94 . . . . 25.0 108.463 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.73 -21.25 55.55 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.135 0.974 . . . . 25.0 111.418 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.0 m -88.21 -46.01 9.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.616 1.166 . . . . 25.0 112.179 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.1 p -93.89 -21.53 19.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.477 0.917 . . . . 25.0 113.477 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.45 0.62 87.39 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 118.337 -1.257 . . . . 25.0 112.558 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -90.36 166.9 13.03 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.037 1.419 . . . . 25.0 111.789 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 p -122.7 145.47 48.36 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.878 1.271 . . . . 25.0 110.513 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.67 -168.41 38.84 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.579 1.085 . . . . 25.0 112.117 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -116.27 137.32 52.24 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.974 1.31 . . . . 25.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.8 pt -144.92 155.29 55.66 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.915 1.286 . . . . 25.0 110.651 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.08 123.96 10.87 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.981 3.121 . . . . 25.0 112.941 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 p -59.46 -36.23 38.57 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-O 115.852 -2.023 . . . . 25.0 115.955 178.282 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.98 -18.73 63.0 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 123.322 2.222 . . . . 25.0 114.376 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -79.56 -3.77 48.4 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.906 0.775 . . . . 25.0 110.938 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.0 mt -119.54 158.2 26.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.087 1.355 . . . . 25.0 112.38 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -142.3 141.09 20.19 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 127.452 2.301 . . . . 25.0 107.967 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.23 146.16 89.89 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.581 2.187 . . . . 25.0 112.229 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 125.085 1.354 . . . . 25.0 108.397 179.688 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.7 mt . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.202 0.525 . . . . 25.0 110.15 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -130.34 150.16 51.7 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.907 1.683 . . . . 25.0 107.194 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -127.34 148.07 50.25 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.354 1.062 . . . . 25.0 110.693 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.41 132.49 37.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.192 1.397 . . . . 25.0 112.212 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.9 mt -89.5 -28.74 19.44 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.338 1.855 . . . . 25.0 112.301 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -151.65 158.71 43.82 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.861 1.264 . . . . 25.0 110.618 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -61.19 149.11 38.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.3 0.64 . . . . 25.0 109.863 176.103 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -147.06 135.11 21.47 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 123.907 0.883 . . . . 25.0 109.878 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -113.57 136.98 52.22 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.02 128.73 38.28 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.554 1.141 . . . . 25.0 111.083 -179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -82.68 -25.83 32.65 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.789 1.236 . . . . 25.0 111.599 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -130.94 168.92 16.53 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.385 1.474 . . . . 25.0 109.98 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.04 -15.83 63.77 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.2 1.0 . . . . 25.0 112.825 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -101.31 -2.64 30.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.778 1.631 . . . . 25.0 113.018 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -94.84 156.79 16.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.562 1.145 . . . . 25.0 110.187 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 mt -97.43 136.24 38.16 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.738 1.215 . . . . 25.0 111.493 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.0 m -98.61 144.02 28.37 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -158.34 173.12 17.15 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.932 0.872 . . . . 25.0 111.438 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -126.43 159.17 34.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.329 1.452 . . . . 25.0 108.572 178.12 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.17 134.26 44.36 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.75 1.22 . . . . 25.0 110.208 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.33 -10.22 65.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.148 1.356 . . . . 25.0 113.462 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.13 138.07 51.61 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 119.255 1.527 . . . . 25.0 110.057 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -102.63 150.76 23.11 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.409 0.684 . . . . 25.0 111.764 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -138.05 159.49 41.89 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.132 1.373 . . . . 25.0 113.682 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -112.75 125.53 54.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.38 -2.822 . . . . 25.0 103.38 176.616 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 mm -85.43 122.53 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.398 -0.964 . . . . 25.0 108.398 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.4 mt -90.19 -41.94 11.32 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.051 0.94 . . . . 25.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -157.57 126.74 5.86 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.841 0.857 . . . . 25.0 109.882 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p -125.69 12.34 7.96 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 114.818 1.414 . . . . 25.0 114.818 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.0 p -93.52 -0.86 56.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.896 1.278 . . . . 25.0 113.364 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -89.58 14.22 12.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.4 1.48 . . . . 25.0 113.761 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.82 -157.88 18.58 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 118.621 0.646 . . . . 25.0 112.796 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -66.35 -6.85 15.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.807 1.643 . . . . 25.0 112.417 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.5 t-105 -109.25 113.49 26.37 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 106.412 -1.699 . . . . 25.0 106.412 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -107.86 153.97 22.25 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.587 0.958 . . . . 25.0 113.587 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -98.63 126.77 44.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.268 2.227 . . . . 25.0 105.162 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.1 m -141.35 170.67 13.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.265 1.031 . . . . 25.0 112.978 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -128.73 125.09 37.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 127.637 2.375 . . . . 25.0 108.079 176.553 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 t -77.7 122.63 25.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 106.753 -1.573 . . . . 25.0 106.753 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.8 mt -78.56 -16.72 57.11 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.597 0.759 . . . . 25.0 111.694 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.9 m -86.68 -43.23 12.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.572 1.149 . . . . 25.0 111.542 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -98.05 -21.8 16.6 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.438 0.903 . . . . 25.0 113.438 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.02 1.74 87.95 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-O 118.297 -1.28 . . . . 25.0 112.499 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -88.04 165.12 15.39 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 119.02 1.41 . . . . 25.0 111.729 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.7 p -122.22 149.14 44.08 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.026 1.331 . . . . 25.0 111.851 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.64 -168.6 39.15 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 125.338 1.447 . . . . 25.0 111.864 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -116.39 142.72 46.49 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.486 1.114 . . . . 25.0 109.966 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.7 pt -145.43 157.56 52.29 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 124.897 1.279 . . . . 25.0 110.659 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.99 124.37 10.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.793 2.995 . . . . 25.0 110.367 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.0 p -57.51 -35.93 40.21 Favored Pre-proline 0 CA--C 1.55 0.948 0 N-CA-C 117.174 2.287 . . . . 25.0 117.174 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.25 -16.0 52.65 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.819 2.346 . . . . 25.0 114.871 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -78.34 -5.41 52.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.094 -0.955 . . . . 25.0 112.103 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.4 mt -119.47 157.98 27.18 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 124.175 0.99 . . . . 25.0 111.433 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.53 138.14 17.12 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 126.653 1.981 . . . . 25.0 108.787 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.75 146.94 80.29 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.85 2.367 . . . . 25.0 111.568 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.533 0.314 0 C-N-CA 124.686 1.194 . . . . 25.0 108.39 179.741 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 71.8 mt . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -122.85 145.7 48.21 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 123.675 0.79 . . . . 25.0 109.713 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -123.82 151.42 43.4 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.629 1.572 . . . . 25.0 110.195 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.01 134.8 36.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.956 1.302 . . . . 25.0 113.236 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.54 -26.56 17.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.284 1.434 . . . . 25.0 111.599 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -147.71 156.35 42.67 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.978 1.311 . . . . 25.0 110.344 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.08 149.16 37.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.083 0.553 . . . . 25.0 109.782 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -148.16 137.9 22.38 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.226 1.01 . . . . 25.0 109.946 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -114.34 138.8 50.07 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.152 -1.425 . . . . 25.0 107.152 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.98 128.36 36.47 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.49 1.116 . . . . 25.0 111.076 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -85.94 -25.16 26.24 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.932 1.293 . . . . 25.0 112.087 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 43.9 p -130.48 170.83 13.71 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.018 1.327 . . . . 25.0 110.211 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -68.1 -17.31 64.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.151 0.98 . . . . 25.0 112.487 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.18 -3.12 27.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.645 1.578 . . . . 25.0 112.635 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.7 156.77 17.34 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.258 1.023 . . . . 25.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.7 mt -104.55 137.67 42.05 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.099 1.36 . . . . 25.0 111.442 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.7 m -96.73 145.75 25.51 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.158 1.383 . . . . 25.0 107.87 177.796 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -158.6 171.11 20.72 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 122.048 0.928 . . . . 25.0 111.859 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -123.09 159.71 27.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.048 1.739 . . . . 25.0 108.053 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.23 134.06 44.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.25 1.02 . . . . 25.0 109.829 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.6 -9.31 68.92 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.06 -1.411 . . . . 25.0 114.129 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -69.74 135.82 50.22 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 119.544 1.672 . . . . 25.0 110.108 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -99.78 151.07 21.67 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.579 0.752 . . . . 25.0 112.255 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -141.83 157.28 45.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.495 1.918 . . . . 25.0 111.675 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -116.14 134.6 54.76 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.695 1.998 . . . . 25.0 106.302 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.5 mm -82.47 126.64 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.645 0.778 . . . . 25.0 111.484 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -98.95 -42.85 6.94 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.585 1.154 . . . . 25.0 108.873 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.68 125.69 5.4 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 124.524 1.13 . . . . 25.0 109.177 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.3 p -125.68 12.47 7.97 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.317 1.599 . . . . 25.0 115.317 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.9 p -92.61 1.19 57.4 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.863 1.265 . . . . 25.0 113.42 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -90.22 16.13 9.15 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.618 1.567 . . . . 25.0 113.595 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.81 -157.9 18.58 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 118.705 0.684 . . . . 25.0 111.946 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.43 -5.43 19.17 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.069 1.348 . . . . 25.0 111.627 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -106.1 110.13 22.29 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.236 1.815 . . . . 25.0 106.358 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -107.68 149.49 28.06 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 113.362 0.875 . . . . 25.0 113.362 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -95.41 128.05 41.95 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.703 2.001 . . . . 25.0 105.719 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -141.74 170.5 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 122.23 1.014 . . . . 25.0 112.927 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -123.66 125.86 45.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 127.346 2.258 . . . . 25.0 106.38 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -76.71 119.66 20.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.492 -1.299 . . . . 25.0 107.492 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.4 mt -74.87 -18.72 60.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.541 0.736 . . . . 25.0 111.641 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.7 m -91.03 -44.5 9.27 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.395 1.078 . . . . 25.0 112.738 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.2 p -99.05 -21.39 16.23 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.29 1.219 . . . . 25.0 114.29 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.55 1.2 90.05 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.352 -1.249 . . . . 25.0 112.576 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.41 160.69 20.56 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.081 1.441 . . . . 25.0 110.943 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 p -120.2 144.31 47.79 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.315 1.046 . . . . 25.0 110.805 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.57 -168.34 38.79 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.519 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -114.93 141.58 47.76 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 125.159 1.384 . . . . 25.0 110.759 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 pt -144.17 150.56 49.16 Favored Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.27 1.428 . . . . 25.0 109.536 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.68 122.89 9.58 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.546 2.83 . . . . 25.0 111.647 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.8 p -59.35 -36.17 38.46 Favored Pre-proline 0 CA--C 1.548 0.893 0 CA-C-O 116.049 -1.929 . . . . 25.0 115.813 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -64.62 -18.59 63.23 Favored 'Trans proline' 0 C--N 1.362 1.248 0 CA-C-N 123.101 2.143 . . . . 25.0 114.624 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -79.32 -4.08 49.15 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.759 0.823 . . . . 25.0 111.0 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.5 mt -118.73 158.45 25.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.25 1.42 . . . . 25.0 112.907 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.79 144.79 43.17 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.572 2.349 . . . . 25.0 108.125 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.25 147.15 91.11 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.829 2.353 . . . . 25.0 111.573 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.899 1.28 . . . . 25.0 108.798 179.862 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 mt . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.853 0.358 . . . . 25.0 110.101 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -131.14 151.39 51.5 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.195 1.398 . . . . 25.0 109.716 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -126.2 153.03 45.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 25.0 110.363 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.81 131.14 35.37 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.362 1.465 . . . . 25.0 112.505 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.8 mt -89.43 -30.41 18.34 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.684 1.594 . . . . 25.0 111.523 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -153.06 163.9 38.99 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.232 1.813 . . . . 25.0 109.681 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.12 149.14 38.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.948 0.899 . . . . 25.0 111.458 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -145.19 137.09 25.6 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.128 1.371 . . . . 25.0 109.628 178.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -113.01 134.88 54.31 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.696 -1.224 . . . . 25.0 107.696 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.97 129.12 39.81 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.446 1.098 . . . . 25.0 109.964 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -93.76 -21.46 19.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.023 0.929 . . . . 25.0 112.567 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.8 p -129.86 171.1 13.08 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.884 1.274 . . . . 25.0 110.36 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.19 -18.36 63.91 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.033 0.933 . . . . 25.0 111.918 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -97.41 -3.64 39.79 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.88 1.672 . . . . 25.0 112.264 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -94.87 158.49 15.46 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.313 1.045 . . . . 25.0 111.296 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.5 mt -111.97 140.11 46.9 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.297 1.439 . . . . 25.0 109.998 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.4 m -95.85 145.8 25.07 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 107.582 -1.266 . . . . 25.0 107.582 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -155.24 169.45 24.14 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 122.021 0.915 . . . . 25.0 110.942 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -123.14 160.4 26.55 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.432 1.493 . . . . 25.0 108.228 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -54.31 134.14 45.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.76 1.224 . . . . 25.0 109.881 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.84 -11.28 68.12 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 125.115 1.34 . . . . 25.0 113.837 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -71.5 137.75 48.4 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 119.376 1.588 . . . . 25.0 110.064 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -106.75 153.27 22.69 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-O 121.781 0.801 . . . . 25.0 112.218 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -140.51 157.91 44.79 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.654 1.982 . . . . 25.0 112.532 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -113.85 136.16 53.17 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 105.105 -2.183 . . . . 25.0 105.105 177.006 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 46.5 mm -82.25 124.36 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.457 0.703 . . . . 25.0 111.199 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 47.9 mt -90.92 -44.03 9.62 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -159.87 129.92 5.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.507 1.123 . . . . 25.0 109.09 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.2 p -125.51 12.45 8.07 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 115.722 1.749 . . . . 25.0 115.722 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.6 p -95.18 5.32 52.12 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.65 1.18 . . . . 25.0 112.718 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -88.51 13.91 10.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.23 1.812 . . . . 25.0 113.788 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.62 -158.0 18.69 Favored Glycine 0 C--N 1.343 0.934 0 N-CA-C 111.633 -0.587 . . . . 25.0 111.633 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -67.85 -7.18 25.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.914 1.286 . . . . 25.0 111.365 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -107.6 116.14 31.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.984 2.114 . . . . 25.0 106.382 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -111.7 153.83 25.87 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.473 0.916 . . . . 25.0 113.473 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -97.28 130.49 44.46 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 126.879 2.072 . . . . 25.0 106.041 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.5 m -140.14 166.74 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 122.256 1.027 . . . . 25.0 113.678 -178.49 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 -125.37 122.82 37.89 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.309 2.244 . . . . 25.0 105.827 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.8 t -76.33 123.14 25.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.803 -0.814 . . . . 25.0 108.803 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.17 -19.43 58.46 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.847 0.859 . . . . 25.0 110.975 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.3 m -88.32 -45.92 9.62 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.165 1.386 . . . . 25.0 112.491 -179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.8 p -97.63 -21.55 16.98 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.915 1.08 . . . . 25.0 113.915 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.33 1.81 88.69 Favored Glycine 0 CA--C 1.538 1.482 0 CA-C-O 118.419 -1.211 . . . . 25.0 112.608 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -87.54 167.18 14.17 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 118.974 1.387 . . . . 25.0 111.417 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 51.3 p -121.0 145.34 47.87 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.771 1.228 . . . . 25.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.56 -168.46 38.99 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.453 1.025 . . . . 25.0 112.646 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -117.19 142.93 46.42 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.914 1.286 . . . . 25.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.4 pt -146.23 150.56 41.84 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.807 1.243 . . . . 25.0 110.283 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.29 123.39 10.21 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.89 3.06 . . . . 25.0 111.464 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.5 p -58.97 -35.84 36.47 Favored Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 116.589 2.07 . . . . 25.0 116.589 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -64.84 -18.53 62.66 Favored 'Trans proline' 0 C--N 1.361 1.207 0 CA-C-N 123.277 2.206 . . . . 25.0 114.797 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.87 -4.18 48.36 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.04 0.836 . . . . 25.0 110.716 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.1 mt -119.82 159.25 24.94 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 125.749 1.62 . . . . 25.0 112.6 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.8 139.46 30.75 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.852 2.061 . . . . 25.0 107.98 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.28 142.52 73.48 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.541 2.161 . . . . 25.0 110.046 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 86.1 t . . . . . 0 CA--C 1.533 0.313 0 C-N-CA 123.73 0.812 . . . . 25.0 108.945 -179.596 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 CA--C 1.536 0.409 0 N-CA-C 108.723 -0.843 . . . . 25.0 108.723 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -131.29 148.39 52.68 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.33 1.052 . . . . 25.0 109.979 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -125.58 155.54 40.53 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.077 1.351 . . . . 25.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.01 133.55 37.96 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.329 1.452 . . . . 25.0 113.624 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.08 -29.34 18.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.265 1.826 . . . . 25.0 112.071 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -152.04 161.5 42.53 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 125.723 1.609 . . . . 25.0 110.093 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -61.04 149.22 37.63 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.984 0.514 . . . . 25.0 109.795 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -145.51 138.58 26.2 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.179 0.991 . . . . 25.0 110.308 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -117.15 135.28 53.88 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.181 -1.414 . . . . 25.0 107.181 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.46 131.18 49.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.077 1.351 . . . . 25.0 111.65 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.2 mtp-105 -83.2 -29.36 28.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 25.0 111.628 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.3 p -131.61 173.62 10.94 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.202 1.401 . . . . 25.0 111.418 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -68.04 -18.65 64.75 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.107 1.363 . . . . 25.0 112.705 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -97.3 -6.33 34.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.463 1.505 . . . . 25.0 112.421 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -95.3 155.95 16.52 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.876 1.27 . . . . 25.0 109.305 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.0 mt -109.95 143.41 39.95 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 124.487 1.115 . . . . 25.0 110.796 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 70.1 m -96.8 147.8 23.56 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.11 1.364 . . . . 25.0 108.116 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -156.07 170.0 23.2 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.755 0.788 . . . . 25.0 111.226 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -120.7 157.24 30.07 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.263 1.425 . . . . 25.0 108.488 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -54.23 134.18 44.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.845 1.258 . . . . 25.0 110.4 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.62 -8.48 68.69 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 125.25 1.405 . . . . 25.0 113.752 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -70.34 133.14 46.65 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 119.168 1.484 . . . . 25.0 110.681 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -97.79 152.69 18.89 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 123.778 0.831 . . . . 25.0 110.971 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -140.29 154.51 46.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.536 1.534 . . . . 25.0 111.564 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -110.14 130.04 55.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 104.53 -2.396 . . . . 25.0 104.53 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -82.9 125.4 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 123.148 0.579 . . . . 25.0 111.009 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.1 mt -95.27 -41.85 8.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.606 1.162 . . . . 25.0 109.341 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -158.58 129.09 6.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.566 1.146 . . . . 25.0 109.401 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 79.8 p -125.6 12.38 8.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.491 1.664 . . . . 25.0 115.491 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.6 p -94.19 2.44 55.93 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.684 1.193 . . . . 25.0 113.298 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -88.57 14.56 9.64 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.689 1.596 . . . . 25.0 114.036 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.67 -158.02 18.66 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 118.533 0.606 . . . . 25.0 112.706 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.4 -2.9 9.5 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.641 1.576 . . . . 25.0 112.258 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.4 t-105 -117.43 120.2 37.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 105.573 -2.01 . . . . 25.0 105.573 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.16 157.54 20.73 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 114.695 1.368 . . . . 25.0 114.695 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -96.97 125.24 41.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.353 2.261 . . . . 25.0 105.346 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.43 171.53 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 122.148 0.975 . . . . 25.0 112.786 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -122.51 125.74 46.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.393 2.277 . . . . 25.0 108.012 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -77.87 119.16 20.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.245 -1.761 . . . . 25.0 106.245 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.86 -17.44 59.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.737 0.815 . . . . 25.0 112.057 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.5 m -84.08 -44.47 14.04 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.747 1.219 . . . . 25.0 112.217 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -100.61 -19.33 16.16 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.023 1.12 . . . . 25.0 114.023 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.12 1.86 88.29 Favored Glycine 0 CA--C 1.539 1.536 0 CA-C-O 118.608 -1.107 . . . . 25.0 112.164 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -83.06 167.15 18.14 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 118.776 1.288 . . . . 25.0 111.153 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 38.3 p -125.05 147.85 48.78 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.707 1.203 . . . . 25.0 110.462 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.82 -168.55 38.97 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.49 1.043 . . . . 25.0 112.044 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -120.12 140.35 51.21 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.418 1.087 . . . . 25.0 110.338 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.0 pt -147.24 156.6 46.41 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.176 1.39 . . . . 25.0 110.793 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.16 123.13 9.98 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.903 3.069 . . . . 25.0 112.755 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 p -59.94 -35.47 28.92 Favored Pre-proline 0 CA--C 1.551 1.016 0 CA-C-O 115.785 -2.055 . . . . 25.0 115.509 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.3 -18.98 65.15 Favored 'Trans proline' 0 C--N 1.363 1.312 0 CA-C-N 123.488 2.281 . . . . 25.0 114.245 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -79.12 -3.12 43.89 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 119.064 0.847 . . . . 25.0 110.335 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 46.2 mt -119.13 158.18 26.43 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.831 1.653 . . . . 25.0 111.494 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.41 142.74 35.89 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.133 2.173 . . . . 25.0 108.478 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.61 145.95 92.06 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.738 2.292 . . . . 25.0 111.03 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.9 t . . . . . 0 CA--C 1.533 0.309 0 C-N-CA 124.115 0.966 . . . . 25.0 108.468 -179.843 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 121.427 0.632 . . . . 25.0 111.361 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -134.63 148.21 50.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.382 1.873 . . . . 25.0 107.671 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -127.46 153.38 46.36 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.628 0.771 . . . . 25.0 111.655 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.57 132.76 42.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.051 1.74 . . . . 25.0 112.495 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -91.8 -28.75 17.16 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.976 1.71 . . . . 25.0 111.887 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -150.86 160.15 44.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.734 1.614 . . . . 25.0 109.652 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -61.04 149.17 37.79 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.717 -0.475 . . . . 25.0 109.717 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -146.55 135.72 22.66 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 124.179 0.991 . . . . 25.0 108.927 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -114.54 139.32 49.68 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.6 126.83 29.15 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.564 1.145 . . . . 25.0 110.558 -179.311 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -86.46 -24.26 25.69 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.742 1.217 . . . . 25.0 111.727 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -129.3 170.11 14.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.454 1.502 . . . . 25.0 109.977 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.78 -16.83 64.31 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.462 1.105 . . . . 25.0 113.02 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.74 -2.45 28.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.572 1.549 . . . . 25.0 113.105 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -91.73 157.98 16.62 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.08 0.952 . . . . 25.0 110.657 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.24 138.05 39.68 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.27 1.428 . . . . 25.0 111.225 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -99.43 142.88 30.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.154 1.382 . . . . 25.0 107.459 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -159.93 173.83 15.32 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.551 0.691 . . . . 25.0 111.942 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -126.01 159.87 31.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.333 1.453 . . . . 25.0 110.374 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -54.19 134.35 44.53 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.321 1.848 . . . . 25.0 110.993 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.12 -11.27 69.46 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.348 1.452 . . . . 25.0 114.107 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -74.2 137.77 43.31 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 118.88 1.34 . . . . 25.0 109.998 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -100.2 153.58 19.15 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.735 0.814 . . . . 25.0 111.245 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -140.01 153.02 46.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.652 1.581 . . . . 25.0 112.238 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -105.35 131.26 53.02 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.643 1.977 . . . . 25.0 105.75 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.38 123.17 38.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.101 -0.703 . . . . 25.0 109.101 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -93.03 -44.62 8.31 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.873 0.869 . . . . 25.0 109.737 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -156.05 130.04 8.6 Favored 'General case' 0 C--N 1.346 0.418 0 C-N-CA 123.652 0.781 . . . . 25.0 110.074 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.9 p -125.59 12.32 8.01 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.158 1.383 . . . . 25.0 114.584 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.1 p -93.9 -2.3 53.52 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.896 1.278 . . . . 25.0 113.04 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -86.19 15.53 5.12 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.518 1.527 . . . . 25.0 112.922 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.78 -158.19 18.56 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-O 121.506 0.503 . . . . 25.0 112.362 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -66.16 -12.14 53.93 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.488 1.515 . . . . 25.0 111.719 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.7 t-105 -101.57 114.61 28.79 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.374 1.869 . . . . 25.0 106.25 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -105.75 150.64 25.33 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 113.403 0.89 . . . . 25.0 113.403 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -96.87 129.38 44.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.541 1.936 . . . . 25.0 105.936 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.41 168.96 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 121.962 0.887 . . . . 25.0 112.671 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -125.88 128.67 47.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.033 2.133 . . . . 25.0 106.922 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 t -78.66 125.03 28.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.371 -0.974 . . . . 25.0 108.371 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.03 -17.15 61.47 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.352 0.661 . . . . 25.0 111.012 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 86.3 m -90.95 -46.21 8.3 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.09 1.356 . . . . 25.0 112.971 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.5 p -100.4 -21.97 15.21 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.514 1.301 . . . . 25.0 114.514 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.35 1.39 85.98 Favored Glycine 0 CA--C 1.537 1.455 0 CA-C-O 118.713 -1.048 . . . . 25.0 112.364 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -81.32 157.93 24.91 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 118.726 1.263 . . . . 25.0 110.727 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.8 p -119.65 144.89 46.92 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.129 0.972 . . . . 25.0 110.286 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.6 -168.37 38.82 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.212 1.387 . . . . 25.0 111.091 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -115.16 140.28 49.21 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.857 0.863 . . . . 25.0 110.706 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.7 pt -141.01 153.22 66.97 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.107 1.363 . . . . 25.0 109.743 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.35 122.89 9.69 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.359 2.706 . . . . 25.0 112.007 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 p -59.74 -36.6 41.17 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 116.11 -1.9 . . . . 25.0 115.205 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.08 -18.56 62.05 Favored 'Trans proline' 0 C--N 1.362 1.248 0 C-N-CA 122.627 2.218 . . . . 25.0 114.659 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.6 -2.31 38.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.205 1.002 . . . . 25.0 110.784 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.1 mt -118.19 158.48 25.03 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.035 1.334 . . . . 25.0 112.753 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.43 138.02 23.72 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.822 2.049 . . . . 25.0 108.304 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.68 138.36 49.07 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.955 2.436 . . . . 25.0 112.17 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.7 t . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 125.646 1.578 . . . . 25.0 108.076 178.437 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 25.0 110.056 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -130.4 146.48 51.97 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.551 1.541 . . . . 25.0 108.408 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -123.32 152.31 41.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.452 1.101 . . . . 25.0 110.937 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.15 134.89 37.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.824 1.65 . . . . 25.0 112.951 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.3 mt -89.6 -29.06 19.11 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.18 1.792 . . . . 25.0 111.909 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -153.8 162.75 40.97 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 125.752 1.621 . . . . 25.0 110.167 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.19 149.26 38.1 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.526 0.73 . . . . 25.0 109.93 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -146.79 135.82 22.47 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.979 0.912 . . . . 25.0 109.277 178.36 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -110.08 136.58 49.1 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.52 127.05 29.6 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.95 0.9 . . . . 25.0 109.534 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 -87.71 -22.23 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.075 0.95 . . . . 25.0 111.698 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -134.08 171.74 13.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.583 1.553 . . . . 25.0 110.214 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -69.03 -17.37 63.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.994 0.918 . . . . 25.0 111.903 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -96.66 -6.17 37.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.92 1.688 . . . . 25.0 112.444 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -94.83 157.86 15.74 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.564 1.146 . . . . 25.0 110.542 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 mt -106.92 139.85 40.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.229 1.412 . . . . 25.0 110.856 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.6 m -97.64 143.38 28.37 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -159.31 173.82 15.71 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.675 0.75 . . . . 25.0 111.382 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -124.3 158.98 31.28 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.362 1.465 . . . . 25.0 109.436 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.31 44.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 25.0 110.849 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.26 -9.27 72.28 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 125.157 1.361 . . . . 25.0 113.797 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.44 135.57 48.81 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.038 1.419 . . . . 25.0 109.631 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -99.75 151.8 20.83 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 121.559 0.695 . . . . 25.0 111.599 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -139.78 157.0 46.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.685 1.594 . . . . 25.0 112.832 -177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -105.9 130.45 53.86 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 127.014 2.126 . . . . 25.0 105.439 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.8 mm -82.94 121.21 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.5 mt -92.79 -43.16 9.16 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.989 0.915 . . . . 25.0 108.741 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -157.95 128.47 6.3 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 124.018 0.927 . . . . 25.0 109.516 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 82.4 p -125.61 12.4 8.01 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.407 1.632 . . . . 25.0 115.407 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -97.44 0.71 48.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.995 1.318 . . . . 25.0 114.243 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -88.16 15.98 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.205 1.402 . . . . 25.0 113.671 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.65 -157.89 18.69 Favored Glycine 0 C--N 1.344 1.027 0 N-CA-C 111.255 -0.738 . . . . 25.0 111.255 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.21 -7.26 28.76 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.351 1.06 . . . . 25.0 111.503 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.2 t-105 -103.12 111.64 24.1 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.26 1.824 . . . . 25.0 106.447 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -111.01 153.17 25.96 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.702 0.801 . . . . 25.0 112.736 -178.65 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -99.09 128.39 45.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.631 1.972 . . . . 25.0 106.178 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.5 m -142.86 169.73 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.079 0.942 . . . . 25.0 112.887 -179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -124.85 126.9 46.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.247 2.219 . . . . 25.0 108.305 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.8 t -78.13 121.69 24.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.022 -1.473 . . . . 25.0 107.022 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.2 mt -78.54 -16.66 57.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.466 0.706 . . . . 25.0 111.19 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -88.67 -45.06 10.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.777 1.231 . . . . 25.0 111.725 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.6 p -95.82 -21.83 17.86 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.336 0.865 . . . . 25.0 113.336 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.07 1.04 89.77 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.085 -1.397 . . . . 25.0 112.832 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -89.85 164.55 14.57 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 119.342 1.571 . . . . 25.0 111.945 -178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.6 p -120.48 147.76 44.71 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 125.071 1.348 . . . . 25.0 111.37 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.54 -168.42 38.93 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.948 1.261 . . . . 25.0 111.9 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -115.24 140.52 49.03 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.323 1.049 . . . . 25.0 110.299 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.0 pt -143.41 149.1 46.58 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.657 1.183 . . . . 25.0 109.236 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -68.7 124.43 11.51 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.867 3.045 . . . . 25.0 111.646 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.6 p -58.08 -35.45 33.95 Favored Pre-proline 0 CA--C 1.549 0.942 0 CA-C-O 115.719 -2.086 . . . . 25.0 116.392 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -64.31 -18.34 62.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 CA-C-N 123.394 2.248 . . . . 25.0 114.044 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.43 -3.63 47.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.742 0.817 . . . . 25.0 110.255 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.2 mt -119.78 158.83 25.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.94 1.696 . . . . 25.0 112.252 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.6 136.96 16.94 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.231 2.213 . . . . 25.0 107.275 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.73 145.85 87.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.735 2.29 . . . . 25.0 111.83 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.2 t . . . . . 0 CA--C 1.534 0.362 0 N-CA-C 107.466 -1.309 . . . . 25.0 107.466 179.12 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.0 mt . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 109.325 -0.62 . . . . 25.0 109.325 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -130.39 148.01 52.16 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.821 1.248 . . . . 25.0 109.154 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -126.25 156.07 40.88 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.616 1.166 . . . . 25.0 111.157 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.81 134.36 36.99 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.394 1.478 . . . . 25.0 112.68 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -87.77 -29.36 21.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.632 1.573 . . . . 25.0 112.143 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -154.69 165.79 35.45 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 126.099 1.759 . . . . 25.0 109.92 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.28 149.18 38.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.728 0.811 . . . . 25.0 110.654 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -149.58 135.92 19.1 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.543 1.137 . . . . 25.0 109.308 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -113.12 137.45 51.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.411 -1.7 . . . . 25.0 106.411 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.89 127.66 33.33 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.039 0.936 . . . . 25.0 111.019 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.0 mtp-105 -88.42 -22.93 23.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.334 1.453 . . . . 25.0 111.728 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.2 p -133.1 170.13 15.84 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 25.0 109.814 179.085 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.6 -18.6 63.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.364 0.666 . . . . 25.0 111.861 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -95.17 -6.55 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.735 1.614 . . . . 25.0 112.096 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -90.66 151.42 21.28 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.809 0.843 . . . . 25.0 110.75 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.3 mt -100.67 134.46 43.59 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.251 1.42 . . . . 25.0 109.222 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.9 m -91.65 142.78 27.24 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.936 -1.505 . . . . 25.0 106.936 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -154.15 168.04 27.84 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 121.654 0.74 . . . . 25.0 111.845 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -125.06 157.81 35.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.175 1.39 . . . . 25.0 108.755 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.18 134.15 44.44 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.355 1.062 . . . . 25.0 110.306 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.26 -8.87 69.72 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-O 118.302 -1.277 . . . . 25.0 113.732 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -69.93 132.22 45.63 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 119.147 1.474 . . . . 25.0 110.388 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -97.9 152.06 19.61 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.025 0.93 . . . . 25.0 110.556 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -140.68 155.4 46.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.736 1.214 . . . . 25.0 112.615 -178.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -106.01 130.19 53.98 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.16 122.3 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 123.368 0.667 . . . . 25.0 109.962 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.8 mt -99.58 -44.35 6.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.001 0.92 . . . . 25.0 110.06 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -156.45 128.46 7.39 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.702 0.801 . . . . 25.0 110.824 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.7 m -125.7 12.54 7.97 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.057 1.343 . . . . 25.0 113.549 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.2 p -93.38 -2.69 54.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.101 0.961 . . . . 25.0 113.525 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -87.82 15.69 6.75 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.385 1.474 . . . . 25.0 113.415 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.94 18.63 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 118.526 0.603 . . . . 25.0 111.964 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -67.26 -9.6 42.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.902 1.281 . . . . 25.0 111.411 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -100.01 107.54 19.5 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 105.948 -1.871 . . . . 25.0 105.948 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m0 -105.13 151.78 23.61 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -98.67 128.03 44.8 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.225 -1.769 . . . . 25.0 106.225 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.6 m -141.62 168.81 14.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.574 0.75 . . . . 25.0 111.085 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.3 ttt-85 -117.73 123.77 46.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.875 -1.528 . . . . 25.0 106.875 177.023 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.5 t -75.62 116.39 16.29 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 105.941 -1.874 . . . . 25.0 105.941 178.657 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -77.66 -16.88 58.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.825 0.85 . . . . 25.0 111.536 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -87.87 -46.69 9.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 25.0 111.826 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.8 p -93.5 -20.71 20.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.45 0.907 . . . . 25.0 113.45 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.26 4.38 90.48 Favored Glycine 0 CA--C 1.538 1.489 0 CA-C-O 118.471 -1.183 . . . . 25.0 112.254 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.89 167.15 13.05 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 119.016 1.408 . . . . 25.0 111.688 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.4 p -121.76 145.12 48.36 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.297 1.439 . . . . 25.0 109.125 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.68 -168.31 38.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.85 0.738 . . . . 25.0 112.633 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -120.16 141.41 49.89 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.874 1.27 . . . . 25.0 111.032 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 pt -146.41 152.86 47.02 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.914 1.285 . . . . 25.0 110.087 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.51 123.47 10.54 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.435 2.756 . . . . 25.0 111.303 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.1 p -58.24 -35.7 36.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 CA-C-O 115.921 -1.99 . . . . 25.0 116.235 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.37 -18.43 63.09 Favored 'Trans proline' 0 C--N 1.361 1.208 0 CA-C-N 123.184 2.173 . . . . 25.0 114.432 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.15 -3.6 46.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.003 0.82 . . . . 25.0 110.702 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.6 mt -118.83 158.43 25.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.813 1.645 . . . . 25.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.29 138.13 26.3 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 127.036 2.134 . . . . 25.0 108.295 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.71 141.24 53.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.731 2.287 . . . . 25.0 111.913 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.4 t . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 107.288 -1.375 . . . . 25.0 107.288 178.459 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 108.824 -0.806 . . . . 25.0 108.824 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -130.38 148.99 52.26 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.734 1.214 . . . . 25.0 109.924 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.12 155.53 35.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.156 1.382 . . . . 25.0 110.127 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.88 130.78 35.22 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.872 1.269 . . . . 25.0 112.697 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.2 mt -89.34 -30.12 18.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 25.0 111.293 178.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -148.45 157.11 43.26 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 125.39 1.476 . . . . 25.0 110.152 -178.86 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -61.04 149.27 37.49 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.27 0.628 . . . . 25.0 110.288 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -144.3 137.31 27.11 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.72 1.208 . . . . 25.0 110.149 178.471 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -114.56 135.31 54.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.995 -1.484 . . . . 25.0 106.995 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.82 128.96 39.1 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.324 1.05 . . . . 25.0 111.314 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -83.87 -29.01 27.56 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.419 1.488 . . . . 25.0 112.038 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 p -132.12 171.66 13.36 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.205 1.402 . . . . 25.0 110.542 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.75 -17.21 64.01 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.019 0.927 . . . . 25.0 111.833 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -95.08 -5.13 45.0 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.149 1.78 . . . . 25.0 112.301 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -97.31 156.56 16.39 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.272 1.029 . . . . 25.0 111.479 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.3 mt -104.44 136.76 43.41 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.562 1.545 . . . . 25.0 110.659 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.6 m -95.02 145.47 24.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -154.67 169.53 23.67 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.822 0.82 . . . . 25.0 111.636 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -125.43 158.43 34.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.392 1.477 . . . . 25.0 108.932 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -54.3 134.21 45.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.763 1.225 . . . . 25.0 110.0 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.59 -11.52 68.37 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 125.06 1.314 . . . . 25.0 113.552 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.83 134.16 47.11 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 119.194 1.497 . . . . 25.0 110.032 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -100.95 154.02 19.03 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.562 0.745 . . . . 25.0 111.243 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -140.39 154.93 46.88 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.956 1.302 . . . . 25.0 113.737 -177.567 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -107.11 129.23 54.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 104.049 -2.575 . . . . 25.0 104.049 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.7 mm -81.36 121.11 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 123.197 0.599 . . . . 25.0 109.913 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -93.04 -42.5 9.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.229 1.012 . . . . 25.0 109.205 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -157.06 126.87 6.22 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.985 0.914 . . . . 25.0 109.913 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.4 p -125.74 12.4 7.93 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.797 1.406 . . . . 25.0 114.797 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.0 p -96.47 -2.16 45.88 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.246 1.419 . . . . 25.0 114.391 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.53 16.31 6.75 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.13 1.372 . . . . 25.0 113.952 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.95 18.63 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 118.75 0.705 . . . . 25.0 112.831 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -67.86 -0.21 4.02 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.734 1.614 . . . . 25.0 112.071 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.6 t-105 -115.92 112.21 21.55 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.834 2.053 . . . . 25.0 106.166 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -110.11 154.12 23.74 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.013 0.925 . . . . 25.0 113.069 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -98.43 127.43 44.36 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 105.426 -2.065 . . . . 25.0 105.426 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.8 m -141.09 168.78 15.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.715 0.769 . . . . 25.0 111.694 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -121.42 123.2 41.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.565 1.546 . . . . 25.0 107.913 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.4 t -74.42 118.34 17.27 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.174 -2.158 . . . . 25.0 105.174 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.45 -12.45 60.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.521 0.728 . . . . 25.0 112.086 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.0 m -88.62 -43.83 11.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.897 1.279 . . . . 25.0 111.567 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 p -98.93 -21.05 16.46 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.987 1.106 . . . . 25.0 113.987 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.14 3.4 89.6 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 118.454 -1.192 . . . . 25.0 112.441 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -85.71 161.48 19.18 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.051 1.425 . . . . 25.0 111.354 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.0 p -120.6 145.32 47.5 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.873 1.269 . . . . 25.0 110.623 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.53 -168.25 38.67 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 124.541 1.067 . . . . 25.0 112.383 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.98 149.24 35.61 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.208 1.403 . . . . 25.0 111.746 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.0 pt -150.04 157.69 37.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.253 1.421 . . . . 25.0 111.003 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -71.26 122.13 8.42 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.978 2.452 . . . . 25.0 108.593 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.4 p -58.39 -35.19 30.59 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 116.953 2.205 . . . . 25.0 116.953 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -63.85 -16.21 53.51 Favored 'Trans proline' 0 C--N 1.36 1.184 0 C-N-CA 122.755 2.303 . . . . 25.0 115.199 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -77.83 -5.21 50.1 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.332 0.969 . . . . 25.0 111.817 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 33.0 mt -119.33 158.46 26.05 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.515 1.126 . . . . 25.0 112.274 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.25 143.26 32.84 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 127.596 2.358 . . . . 25.0 108.428 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -62.44 146.59 95.6 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.809 2.34 . . . . 25.0 111.272 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 CA--C 1.532 0.264 0 C-N-CA 123.971 0.909 . . . . 25.0 109.919 -178.891 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 119.322 -0.371 . . . . 25.0 110.051 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 t -149.49 157.66 43.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.331 1.453 . . . . 25.0 110.521 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.58 160.83 26.27 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.592 -0.892 . . . . 25.0 108.592 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -130.16 147.97 51.95 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.247 1.019 . . . . 25.0 109.366 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -121.5 152.65 38.93 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.092 1.357 . . . . 25.0 110.705 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.89 135.57 35.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.201 1.4 . . . . 25.0 113.366 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 86.1 mt -98.47 -24.56 15.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.064 1.745 . . . . 25.0 112.242 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.03 153.04 38.43 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.557 1.143 . . . . 25.0 110.527 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.1 149.22 37.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 109.332 -0.618 . . . . 25.0 109.332 175.686 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -146.61 137.23 23.93 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.719 0.807 . . . . 25.0 109.592 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -112.89 136.87 52.06 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 106.972 -1.492 . . . . 25.0 106.972 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.39 127.92 34.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.261 1.025 . . . . 25.0 110.068 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -93.59 -20.42 20.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.422 1.089 . . . . 25.0 112.338 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.0 p -130.07 171.27 13.0 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.027 1.331 . . . . 25.0 110.119 179.142 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.06 -18.97 64.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.248 1.019 . . . . 25.0 112.366 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -101.96 -2.93 28.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.771 1.628 . . . . 25.0 112.815 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.0 156.06 18.24 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.28 0.945 . . . . 25.0 110.87 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 mt -107.22 140.47 40.04 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.314 1.446 . . . . 25.0 110.787 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.5 m -97.5 145.07 26.58 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.674 1.19 . . . . 25.0 107.834 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -156.82 170.81 21.62 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.714 0.769 . . . . 25.0 111.074 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -122.87 156.81 33.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.337 1.455 . . . . 25.0 108.727 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.21 44.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.702 1.201 . . . . 25.0 110.198 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.45 -9.54 66.93 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.343 1.449 . . . . 25.0 113.38 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.34 133.97 46.38 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.066 1.433 . . . . 25.0 110.19 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -102.05 152.62 20.76 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.69 0.796 . . . . 25.0 110.616 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.3 156.23 48.5 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.292 1.437 . . . . 25.0 112.822 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -107.45 128.98 54.97 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 104.648 -2.353 . . . . 25.0 104.648 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.5 mm -82.07 123.0 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.511 0.725 . . . . 25.0 110.995 -177.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.0 mt -91.45 -44.48 9.09 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.171 -1.048 . . . . 25.0 108.171 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -158.83 127.46 5.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.408 1.083 . . . . 25.0 108.948 178.314 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.2 p -125.62 12.5 8.01 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.6 p -93.28 5.32 51.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.524 1.13 . . . . 25.0 112.773 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -91.15 12.43 20.05 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.846 1.658 . . . . 25.0 114.711 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.66 -157.81 18.7 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 118.651 0.66 . . . . 25.0 111.529 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -69.47 -1.12 7.7 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.883 1.273 . . . . 25.0 111.717 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -112.15 105.74 14.17 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.52 1.928 . . . . 25.0 106.456 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -105.38 151.08 24.64 Favored 'General case' 0 C--N 1.345 0.385 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -96.02 126.37 41.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.472 -2.048 . . . . 25.0 105.472 177.818 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.1 m -142.86 168.28 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.933 0.873 . . . . 25.0 112.605 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -121.35 127.62 51.45 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.522 1.929 . . . . 25.0 107.738 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.7 t -76.54 119.66 20.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 106.788 -1.56 . . . . 25.0 106.788 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.4 mt -76.74 -15.9 59.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.334 0.654 . . . . 25.0 111.207 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.6 m -87.59 -46.08 9.86 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.146 1.378 . . . . 25.0 112.265 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.9 p -101.19 -21.05 15.03 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.472 1.286 . . . . 25.0 114.472 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.76 2.34 90.5 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.558 -1.134 . . . . 25.0 112.451 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -84.59 160.94 20.34 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-N 119.005 1.403 . . . . 25.0 110.871 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 37.0 p -121.07 144.28 48.63 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 124.461 1.104 . . . . 25.0 111.202 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.47 -168.46 39.03 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.478 1.037 . . . . 25.0 112.559 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -115.17 143.21 45.58 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 125.183 1.393 . . . . 25.0 111.006 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.3 pt -145.22 154.79 54.35 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 125.278 1.431 . . . . 25.0 109.82 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.43 122.63 9.39 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.911 2.407 . . . . 25.0 111.361 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.0 t -58.86 -36.99 48.69 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-O 116.154 -1.879 . . . . 25.0 115.042 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -63.63 -17.74 61.25 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.539 2.159 . . . . 25.0 114.684 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.64 -3.92 46.37 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.088 0.858 . . . . 25.0 110.343 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.5 mt -118.84 158.44 25.65 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.491 1.516 . . . . 25.0 112.371 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.78 141.88 36.76 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.13 2.172 . . . . 25.0 108.837 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.9 141.64 59.5 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.697 2.265 . . . . 25.0 111.113 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 87.6 t -72.75 136.01 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.675 1.19 . . . . 25.0 108.19 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.135 2.574 . . . . 25.0 109.663 179.907 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.476 0.849 0 CA-C-O 120.969 0.414 . . . . 25.0 111.756 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.8 t -132.75 148.33 52.32 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.034 1.334 . . . . 25.0 110.109 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 58.0 mt -84.33 163.73 19.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.519 1.128 . . . . 25.0 109.407 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -131.95 157.1 44.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.112 1.365 . . . . 25.0 111.506 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -133.66 152.23 51.84 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.855 1.662 . . . . 25.0 110.142 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.76 133.1 37.13 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.741 1.616 . . . . 25.0 113.112 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.8 mt -94.46 -28.42 15.49 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.419 1.888 . . . . 25.0 112.391 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -146.58 155.22 42.32 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 124.757 1.223 . . . . 25.0 110.436 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -61.19 149.13 38.5 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.842 -0.799 . . . . 25.0 108.842 175.727 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -147.63 138.64 23.5 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 123.539 0.736 . . . . 25.0 109.996 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -116.97 137.67 52.07 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 107.731 -1.211 . . . . 25.0 107.731 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.3 130.59 46.89 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.309 1.044 . . . . 25.0 111.259 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -90.93 -26.19 19.41 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.48 1.112 . . . . 25.0 111.925 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.0 p -131.14 172.45 12.1 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.317 1.447 . . . . 25.0 110.437 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.64 -18.79 64.35 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.084 0.953 . . . . 25.0 112.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -94.86 -8.15 38.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.562 1.545 . . . . 25.0 112.3 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -94.27 156.67 16.41 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.332 1.053 . . . . 25.0 110.259 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 mt -112.11 141.43 45.79 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.83 1.252 . . . . 25.0 110.143 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.7 p -99.34 146.21 26.51 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.002 1.321 . . . . 25.0 108.126 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.23 175.68 13.13 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.801 0.81 . . . . 25.0 111.059 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -126.88 159.61 33.44 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.151 1.38 . . . . 25.0 108.532 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.19 134.31 44.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.609 1.164 . . . . 25.0 110.292 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.65 -11.27 62.9 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 125.234 1.397 . . . . 25.0 113.489 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -70.4 136.67 49.8 Favored 'General case' 0 C--N 1.347 0.483 0 CA-C-N 119.212 1.506 . . . . 25.0 109.452 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -101.67 150.05 23.51 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.84 0.829 . . . . 25.0 112.049 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -141.47 161.28 38.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.809 2.044 . . . . 25.0 111.295 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -121.51 137.87 54.54 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.459 2.303 . . . . 25.0 105.629 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -86.73 127.66 40.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 122.778 0.431 . . . . 25.0 110.603 -178.433 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.8 mt -97.47 -41.08 8.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.694 1.198 . . . . 25.0 109.85 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -156.0 130.85 9.15 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.917 0.887 . . . . 25.0 109.962 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.6 p -125.64 12.37 7.99 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.447 1.647 . . . . 25.0 115.447 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.4 p -95.11 0.22 54.08 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.866 1.267 . . . . 25.0 113.225 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -88.84 16.12 7.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.746 1.618 . . . . 25.0 113.433 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.86 -158.18 18.5 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 118.497 0.59 . . . . 25.0 112.869 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.64 -7.72 35.68 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.298 1.439 . . . . 25.0 112.19 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -111.57 123.08 49.5 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 105.691 -1.966 . . . . 25.0 105.691 177.86 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.29 157.0 21.48 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.221 1.193 . . . . 25.0 114.221 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.85 131.97 41.61 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.58 1.952 . . . . 25.0 106.283 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.9 m -139.19 167.76 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.538 1.161 . . . . 25.0 113.922 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -125.65 114.76 19.12 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.738 2.815 . . . . 25.0 104.919 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.8 t -74.99 121.92 22.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.463 -0.94 . . . . 25.0 108.463 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.73 -21.25 55.55 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.135 0.974 . . . . 25.0 111.418 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.0 m -88.21 -46.01 9.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.616 1.166 . . . . 25.0 112.179 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.1 p -93.89 -21.53 19.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.477 0.917 . . . . 25.0 113.477 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.45 0.62 87.39 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 118.337 -1.257 . . . . 25.0 112.558 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -90.36 166.9 13.03 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.037 1.419 . . . . 25.0 111.789 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 p -122.7 145.47 48.36 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.878 1.271 . . . . 25.0 110.513 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.67 -168.41 38.84 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.579 1.085 . . . . 25.0 112.117 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -116.27 137.32 52.24 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.974 1.31 . . . . 25.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.8 pt -144.92 155.29 55.66 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.915 1.286 . . . . 25.0 110.651 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.08 123.96 10.87 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.981 3.121 . . . . 25.0 112.941 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 p -59.46 -36.23 38.57 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-O 115.852 -2.023 . . . . 25.0 115.955 178.282 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.98 -18.73 63.0 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 123.322 2.222 . . . . 25.0 114.376 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -79.56 -3.77 48.4 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.906 0.775 . . . . 25.0 110.938 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.0 mt -119.54 158.2 26.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.087 1.355 . . . . 25.0 112.38 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -142.3 141.09 20.19 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 127.452 2.301 . . . . 25.0 107.967 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.23 146.16 89.89 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.581 2.187 . . . . 25.0 112.229 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.55 136.06 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.085 1.354 . . . . 25.0 108.397 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 . . . . . 0 C--O 1.251 1.148 0 C-N-CA 127.699 2.4 . . . . 25.0 109.577 179.808 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.925 0.393 . . . . 25.0 111.44 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.1 t -133.4 154.7 50.54 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.435 1.494 . . . . 25.0 109.879 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.7 mt -78.43 153.22 31.69 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.98 0.912 . . . . 25.0 110.15 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -130.34 150.16 51.7 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.907 1.683 . . . . 25.0 107.194 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -127.34 148.07 50.25 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.354 1.062 . . . . 25.0 110.693 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.41 132.49 37.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.192 1.397 . . . . 25.0 112.212 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.9 mt -89.5 -28.74 19.44 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.338 1.855 . . . . 25.0 112.301 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -151.65 158.71 43.82 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.861 1.264 . . . . 25.0 110.618 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -61.19 149.11 38.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.3 0.64 . . . . 25.0 109.863 176.103 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -147.06 135.11 21.47 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 123.907 0.883 . . . . 25.0 109.878 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -113.57 136.98 52.22 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.02 128.73 38.28 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.554 1.141 . . . . 25.0 111.083 -179.221 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -82.68 -25.83 32.65 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.789 1.236 . . . . 25.0 111.599 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -130.94 168.92 16.53 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.385 1.474 . . . . 25.0 109.98 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.04 -15.83 63.77 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.2 1.0 . . . . 25.0 112.825 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -101.31 -2.64 30.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.778 1.631 . . . . 25.0 113.018 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -94.84 156.79 16.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.562 1.145 . . . . 25.0 110.187 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 mt -97.43 136.24 38.16 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.738 1.215 . . . . 25.0 111.493 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.0 m -98.61 144.02 28.37 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -158.34 173.12 17.15 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.932 0.872 . . . . 25.0 111.438 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -126.43 159.17 34.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.329 1.452 . . . . 25.0 108.572 178.12 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.17 134.26 44.36 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.75 1.22 . . . . 25.0 110.208 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.33 -10.22 65.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.148 1.356 . . . . 25.0 113.462 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.13 138.07 51.61 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 119.255 1.527 . . . . 25.0 110.057 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -102.63 150.76 23.11 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.409 0.684 . . . . 25.0 111.764 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -138.05 159.49 41.89 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.132 1.373 . . . . 25.0 113.682 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -112.75 125.53 54.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.38 -2.822 . . . . 25.0 103.38 176.616 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 mm -85.43 122.53 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.398 -0.964 . . . . 25.0 108.398 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.4 mt -90.19 -41.94 11.32 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.051 0.94 . . . . 25.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.4 t-20 -157.57 126.74 5.86 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.841 0.857 . . . . 25.0 109.882 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p -125.69 12.34 7.96 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 114.818 1.414 . . . . 25.0 114.818 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.0 p -93.52 -0.86 56.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.896 1.278 . . . . 25.0 113.364 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -89.58 14.22 12.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.4 1.48 . . . . 25.0 113.761 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.82 -157.88 18.58 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 118.621 0.646 . . . . 25.0 112.796 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -66.35 -6.85 15.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.807 1.643 . . . . 25.0 112.417 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.5 t-105 -109.25 113.49 26.37 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 106.412 -1.699 . . . . 25.0 106.412 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -107.86 153.97 22.25 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.587 0.958 . . . . 25.0 113.587 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -98.63 126.77 44.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.268 2.227 . . . . 25.0 105.162 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.1 m -141.35 170.67 13.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.265 1.031 . . . . 25.0 112.978 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -128.73 125.09 37.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 127.637 2.375 . . . . 25.0 108.079 176.553 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 t -77.7 122.63 25.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 106.753 -1.573 . . . . 25.0 106.753 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.8 mt -78.56 -16.72 57.11 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.597 0.759 . . . . 25.0 111.694 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.9 m -86.68 -43.23 12.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.572 1.149 . . . . 25.0 111.542 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -98.05 -21.8 16.6 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.438 0.903 . . . . 25.0 113.438 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.02 1.74 87.95 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-O 118.297 -1.28 . . . . 25.0 112.499 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -88.04 165.12 15.39 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 119.02 1.41 . . . . 25.0 111.729 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.7 p -122.22 149.14 44.08 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.026 1.331 . . . . 25.0 111.851 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.64 -168.6 39.15 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 125.338 1.447 . . . . 25.0 111.864 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -116.39 142.72 46.49 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.486 1.114 . . . . 25.0 109.966 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.7 pt -145.43 157.56 52.29 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 124.897 1.279 . . . . 25.0 110.659 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.99 124.37 10.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.793 2.995 . . . . 25.0 110.367 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.0 p -57.51 -35.93 40.21 Favored Pre-proline 0 CA--C 1.55 0.948 0 N-CA-C 117.174 2.287 . . . . 25.0 117.174 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.25 -16.0 52.65 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.819 2.346 . . . . 25.0 114.871 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -78.34 -5.41 52.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.094 -0.955 . . . . 25.0 112.103 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.4 mt -119.47 157.98 27.18 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 124.175 0.99 . . . . 25.0 111.433 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.53 138.14 17.12 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 126.653 1.981 . . . . 25.0 108.787 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.75 146.94 80.29 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.85 2.367 . . . . 25.0 111.568 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.47 136.02 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.686 1.194 . . . . 25.0 108.39 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.164 1.386 . . . . 25.0 108.66 -179.426 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 N--CA 1.475 0.792 0 CA-C-O 120.854 0.359 . . . . 25.0 110.729 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 t -153.76 162.63 41.07 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.314 1.446 . . . . 25.0 110.603 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.19 160.19 31.51 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -122.85 145.7 48.21 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 123.675 0.79 . . . . 25.0 109.713 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -123.82 151.42 43.4 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.629 1.572 . . . . 25.0 110.195 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.01 134.8 36.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.956 1.302 . . . . 25.0 113.236 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.54 -26.56 17.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.284 1.434 . . . . 25.0 111.599 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -147.71 156.35 42.67 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.978 1.311 . . . . 25.0 110.344 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.08 149.16 37.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.083 0.553 . . . . 25.0 109.782 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -148.16 137.9 22.38 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.226 1.01 . . . . 25.0 109.946 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -114.34 138.8 50.07 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.152 -1.425 . . . . 25.0 107.152 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.98 128.36 36.47 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.49 1.116 . . . . 25.0 111.076 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -85.94 -25.16 26.24 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.932 1.293 . . . . 25.0 112.087 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 43.9 p -130.48 170.83 13.71 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.018 1.327 . . . . 25.0 110.211 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -68.1 -17.31 64.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.151 0.98 . . . . 25.0 112.487 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.18 -3.12 27.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.645 1.578 . . . . 25.0 112.635 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.7 156.77 17.34 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.258 1.023 . . . . 25.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.7 mt -104.55 137.67 42.05 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.099 1.36 . . . . 25.0 111.442 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.7 m -96.73 145.75 25.51 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.158 1.383 . . . . 25.0 107.87 177.796 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -158.6 171.11 20.72 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 122.048 0.928 . . . . 25.0 111.859 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -123.09 159.71 27.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.048 1.739 . . . . 25.0 108.053 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.23 134.06 44.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.25 1.02 . . . . 25.0 109.829 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.6 -9.31 68.92 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.06 -1.411 . . . . 25.0 114.129 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -69.74 135.82 50.22 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 119.544 1.672 . . . . 25.0 110.108 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -99.78 151.07 21.67 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.579 0.752 . . . . 25.0 112.255 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -141.83 157.28 45.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.495 1.918 . . . . 25.0 111.675 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -116.14 134.6 54.76 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.695 1.998 . . . . 25.0 106.302 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.5 mm -82.47 126.64 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.645 0.778 . . . . 25.0 111.484 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -98.95 -42.85 6.94 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.585 1.154 . . . . 25.0 108.873 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.68 125.69 5.4 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 124.524 1.13 . . . . 25.0 109.177 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.3 p -125.68 12.47 7.97 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.317 1.599 . . . . 25.0 115.317 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.9 p -92.61 1.19 57.4 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.863 1.265 . . . . 25.0 113.42 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -90.22 16.13 9.15 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.618 1.567 . . . . 25.0 113.595 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.81 -157.9 18.58 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 118.705 0.684 . . . . 25.0 111.946 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.43 -5.43 19.17 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.069 1.348 . . . . 25.0 111.627 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -106.1 110.13 22.29 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.236 1.815 . . . . 25.0 106.358 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -107.68 149.49 28.06 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 113.362 0.875 . . . . 25.0 113.362 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -95.41 128.05 41.95 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.703 2.001 . . . . 25.0 105.719 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -141.74 170.5 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 122.23 1.014 . . . . 25.0 112.927 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -123.66 125.86 45.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 127.346 2.258 . . . . 25.0 106.38 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -76.71 119.66 20.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.492 -1.299 . . . . 25.0 107.492 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.4 mt -74.87 -18.72 60.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.541 0.736 . . . . 25.0 111.641 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.7 m -91.03 -44.5 9.27 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.395 1.078 . . . . 25.0 112.738 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.2 p -99.05 -21.39 16.23 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.29 1.219 . . . . 25.0 114.29 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.55 1.2 90.05 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.352 -1.249 . . . . 25.0 112.576 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.41 160.69 20.56 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.081 1.441 . . . . 25.0 110.943 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 p -120.2 144.31 47.79 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.315 1.046 . . . . 25.0 110.805 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.57 -168.34 38.79 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.519 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -114.93 141.58 47.76 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 125.159 1.384 . . . . 25.0 110.759 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 pt -144.17 150.56 49.16 Favored Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.27 1.428 . . . . 25.0 109.536 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.68 122.89 9.58 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.546 2.83 . . . . 25.0 111.647 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.8 p -59.35 -36.17 38.46 Favored Pre-proline 0 CA--C 1.548 0.893 0 CA-C-O 116.049 -1.929 . . . . 25.0 115.813 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -64.62 -18.59 63.23 Favored 'Trans proline' 0 C--N 1.362 1.248 0 CA-C-N 123.101 2.143 . . . . 25.0 114.624 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -79.32 -4.08 49.15 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.759 0.823 . . . . 25.0 111.0 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.5 mt -118.73 158.45 25.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.25 1.42 . . . . 25.0 112.907 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.79 144.79 43.17 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.572 2.349 . . . . 25.0 108.125 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.25 147.15 91.11 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.829 2.353 . . . . 25.0 111.573 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.57 136.0 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.899 1.28 . . . . 25.0 108.798 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 . . . . . 0 C--O 1.25 1.115 0 C-N-CA 127.398 2.279 . . . . 25.0 109.805 179.831 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.472 0.626 0 CA-C-O 119.211 -0.424 . . . . 25.0 109.958 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.0 t -144.56 152.26 40.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.148 1.379 . . . . 25.0 110.187 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 mt -83.63 163.32 20.4 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.372 1.069 . . . . 25.0 110.101 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -131.14 151.39 51.5 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.195 1.398 . . . . 25.0 109.716 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -126.2 153.03 45.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 25.0 110.363 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.81 131.14 35.37 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.362 1.465 . . . . 25.0 112.505 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.8 mt -89.43 -30.41 18.34 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.684 1.594 . . . . 25.0 111.523 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -153.06 163.9 38.99 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.232 1.813 . . . . 25.0 109.681 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.12 149.14 38.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.948 0.899 . . . . 25.0 111.458 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -145.19 137.09 25.6 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.128 1.371 . . . . 25.0 109.628 178.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -113.01 134.88 54.31 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.696 -1.224 . . . . 25.0 107.696 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.97 129.12 39.81 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.446 1.098 . . . . 25.0 109.964 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -93.76 -21.46 19.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.023 0.929 . . . . 25.0 112.567 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.8 p -129.86 171.1 13.08 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.884 1.274 . . . . 25.0 110.36 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.19 -18.36 63.91 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.033 0.933 . . . . 25.0 111.918 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -97.41 -3.64 39.79 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.88 1.672 . . . . 25.0 112.264 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -94.87 158.49 15.46 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.313 1.045 . . . . 25.0 111.296 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.5 mt -111.97 140.11 46.9 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.297 1.439 . . . . 25.0 109.998 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.4 m -95.85 145.8 25.07 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 107.582 -1.266 . . . . 25.0 107.582 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -155.24 169.45 24.14 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 122.021 0.915 . . . . 25.0 110.942 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -123.14 160.4 26.55 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.432 1.493 . . . . 25.0 108.228 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -54.31 134.14 45.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.76 1.224 . . . . 25.0 109.881 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.84 -11.28 68.12 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 125.115 1.34 . . . . 25.0 113.837 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -71.5 137.75 48.4 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 119.376 1.588 . . . . 25.0 110.064 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -106.75 153.27 22.69 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-O 121.781 0.801 . . . . 25.0 112.218 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -140.51 157.91 44.79 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.654 1.982 . . . . 25.0 112.532 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -113.85 136.16 53.17 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 105.105 -2.183 . . . . 25.0 105.105 177.006 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 46.5 mm -82.25 124.36 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.457 0.703 . . . . 25.0 111.199 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 47.9 mt -90.92 -44.03 9.62 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.2 t-20 -159.87 129.92 5.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.507 1.123 . . . . 25.0 109.09 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.2 p -125.51 12.45 8.07 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 115.722 1.749 . . . . 25.0 115.722 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.6 p -95.18 5.32 52.12 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.65 1.18 . . . . 25.0 112.718 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -88.51 13.91 10.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.23 1.812 . . . . 25.0 113.788 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.62 -158.0 18.69 Favored Glycine 0 C--N 1.343 0.934 0 N-CA-C 111.633 -0.587 . . . . 25.0 111.633 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -67.85 -7.18 25.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.914 1.286 . . . . 25.0 111.365 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -107.6 116.14 31.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.984 2.114 . . . . 25.0 106.382 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -111.7 153.83 25.87 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.473 0.916 . . . . 25.0 113.473 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -97.28 130.49 44.46 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 126.879 2.072 . . . . 25.0 106.041 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.5 m -140.14 166.74 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 122.256 1.027 . . . . 25.0 113.678 -178.49 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 -125.37 122.82 37.89 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.309 2.244 . . . . 25.0 105.827 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.8 t -76.33 123.14 25.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.803 -0.814 . . . . 25.0 108.803 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.17 -19.43 58.46 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.847 0.859 . . . . 25.0 110.975 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.3 m -88.32 -45.92 9.62 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.165 1.386 . . . . 25.0 112.491 -179.224 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.8 p -97.63 -21.55 16.98 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.915 1.08 . . . . 25.0 113.915 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.33 1.81 88.69 Favored Glycine 0 CA--C 1.538 1.482 0 CA-C-O 118.419 -1.211 . . . . 25.0 112.608 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -87.54 167.18 14.17 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 118.974 1.387 . . . . 25.0 111.417 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 51.3 p -121.0 145.34 47.87 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.771 1.228 . . . . 25.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.56 -168.46 38.99 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.453 1.025 . . . . 25.0 112.646 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -117.19 142.93 46.42 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.914 1.286 . . . . 25.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.4 pt -146.23 150.56 41.84 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.807 1.243 . . . . 25.0 110.283 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.29 123.39 10.21 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.89 3.06 . . . . 25.0 111.464 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.5 p -58.97 -35.84 36.47 Favored Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 116.589 2.07 . . . . 25.0 116.589 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -64.84 -18.53 62.66 Favored 'Trans proline' 0 C--N 1.361 1.207 0 CA-C-N 123.277 2.206 . . . . 25.0 114.797 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.87 -4.18 48.36 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.04 0.836 . . . . 25.0 110.716 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.1 mt -119.82 159.25 24.94 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 125.749 1.62 . . . . 25.0 112.6 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.8 139.46 30.75 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.852 2.061 . . . . 25.0 107.98 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.28 142.52 73.48 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.541 2.161 . . . . 25.0 110.046 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.57 135.76 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.73 0.812 . . . . 25.0 108.945 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 . . . . . 0 C--O 1.252 1.2 0 C-N-CA 127.373 2.269 . . . . 25.0 111.748 179.576 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 119.174 -0.441 . . . . 25.0 111.952 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.4 t -132.44 151.06 52.03 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.812 1.245 . . . . 25.0 111.145 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.0 mt -83.64 164.49 19.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.968 1.307 . . . . 25.0 108.723 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -131.29 148.39 52.68 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.33 1.052 . . . . 25.0 109.979 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -125.58 155.54 40.53 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.077 1.351 . . . . 25.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.01 133.55 37.96 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.329 1.452 . . . . 25.0 113.624 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.08 -29.34 18.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.265 1.826 . . . . 25.0 112.071 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -152.04 161.5 42.53 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 125.723 1.609 . . . . 25.0 110.093 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -61.04 149.22 37.63 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.984 0.514 . . . . 25.0 109.795 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -145.51 138.58 26.2 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.179 0.991 . . . . 25.0 110.308 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -117.15 135.28 53.88 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.181 -1.414 . . . . 25.0 107.181 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.46 131.18 49.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.077 1.351 . . . . 25.0 111.65 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.2 mtp-105 -83.2 -29.36 28.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 25.0 111.628 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.3 p -131.61 173.62 10.94 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.202 1.401 . . . . 25.0 111.418 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -68.04 -18.65 64.75 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.107 1.363 . . . . 25.0 112.705 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -97.3 -6.33 34.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.463 1.505 . . . . 25.0 112.421 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -95.3 155.95 16.52 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.876 1.27 . . . . 25.0 109.305 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.0 mt -109.95 143.41 39.95 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 124.487 1.115 . . . . 25.0 110.796 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 70.1 m -96.8 147.8 23.56 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.11 1.364 . . . . 25.0 108.116 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -156.07 170.0 23.2 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.755 0.788 . . . . 25.0 111.226 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -120.7 157.24 30.07 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.263 1.425 . . . . 25.0 108.488 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -54.23 134.18 44.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.845 1.258 . . . . 25.0 110.4 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.62 -8.48 68.69 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 125.25 1.405 . . . . 25.0 113.752 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -70.34 133.14 46.65 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 119.168 1.484 . . . . 25.0 110.681 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -97.79 152.69 18.89 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 123.778 0.831 . . . . 25.0 110.971 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -140.29 154.51 46.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.536 1.534 . . . . 25.0 111.564 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -110.14 130.04 55.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 104.53 -2.396 . . . . 25.0 104.53 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -82.9 125.4 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 123.148 0.579 . . . . 25.0 111.009 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.1 mt -95.27 -41.85 8.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.606 1.162 . . . . 25.0 109.341 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.6 t-20 -158.58 129.09 6.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.566 1.146 . . . . 25.0 109.401 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 79.8 p -125.6 12.38 8.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.491 1.664 . . . . 25.0 115.491 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.6 p -94.19 2.44 55.93 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.684 1.193 . . . . 25.0 113.298 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -88.57 14.56 9.64 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.689 1.596 . . . . 25.0 114.036 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.67 -158.02 18.66 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 118.533 0.606 . . . . 25.0 112.706 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.4 -2.9 9.5 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.641 1.576 . . . . 25.0 112.258 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.4 t-105 -117.43 120.2 37.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 105.573 -2.01 . . . . 25.0 105.573 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.16 157.54 20.73 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 114.695 1.368 . . . . 25.0 114.695 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -96.97 125.24 41.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.353 2.261 . . . . 25.0 105.346 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.43 171.53 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 122.148 0.975 . . . . 25.0 112.786 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -122.51 125.74 46.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.393 2.277 . . . . 25.0 108.012 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -77.87 119.16 20.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.245 -1.761 . . . . 25.0 106.245 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.86 -17.44 59.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.737 0.815 . . . . 25.0 112.057 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.5 m -84.08 -44.47 14.04 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.747 1.219 . . . . 25.0 112.217 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -100.61 -19.33 16.16 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.023 1.12 . . . . 25.0 114.023 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.12 1.86 88.29 Favored Glycine 0 CA--C 1.539 1.536 0 CA-C-O 118.608 -1.107 . . . . 25.0 112.164 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -83.06 167.15 18.14 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 118.776 1.288 . . . . 25.0 111.153 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 38.3 p -125.05 147.85 48.78 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.707 1.203 . . . . 25.0 110.462 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.82 -168.55 38.97 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.49 1.043 . . . . 25.0 112.044 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -120.12 140.35 51.21 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.418 1.087 . . . . 25.0 110.338 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.0 pt -147.24 156.6 46.41 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.176 1.39 . . . . 25.0 110.793 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.16 123.13 9.98 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.903 3.069 . . . . 25.0 112.755 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 p -59.94 -35.47 28.92 Favored Pre-proline 0 CA--C 1.551 1.016 0 CA-C-O 115.785 -2.055 . . . . 25.0 115.509 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.3 -18.98 65.15 Favored 'Trans proline' 0 C--N 1.363 1.312 0 CA-C-N 123.488 2.281 . . . . 25.0 114.245 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -79.12 -3.12 43.89 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 119.064 0.847 . . . . 25.0 110.335 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 46.2 mt -119.13 158.18 26.43 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.831 1.653 . . . . 25.0 111.494 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.41 142.74 35.89 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.133 2.173 . . . . 25.0 108.478 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.61 145.95 92.06 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.738 2.292 . . . . 25.0 111.03 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.9 t -72.42 135.85 26.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.115 0.966 . . . . 25.0 108.468 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 127.223 2.209 . . . . 25.0 109.665 -179.906 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 t . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 120.711 0.291 . . . . 25.0 111.287 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.0 t -126.98 147.77 50.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.224 1.41 . . . . 25.0 109.345 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.5 mt -86.9 162.87 17.48 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.214 1.006 . . . . 25.0 111.361 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -134.63 148.21 50.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.382 1.873 . . . . 25.0 107.671 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -127.46 153.38 46.36 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.628 0.771 . . . . 25.0 111.655 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.57 132.76 42.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.051 1.74 . . . . 25.0 112.495 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -91.8 -28.75 17.16 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.976 1.71 . . . . 25.0 111.887 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -150.86 160.15 44.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.734 1.614 . . . . 25.0 109.652 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -61.04 149.17 37.79 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.717 -0.475 . . . . 25.0 109.717 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -146.55 135.72 22.66 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 124.179 0.991 . . . . 25.0 108.927 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -114.54 139.32 49.68 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.6 126.83 29.15 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.564 1.145 . . . . 25.0 110.558 -179.311 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -86.46 -24.26 25.69 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.742 1.217 . . . . 25.0 111.727 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -129.3 170.11 14.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.454 1.502 . . . . 25.0 109.977 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.78 -16.83 64.31 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.462 1.105 . . . . 25.0 113.02 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.74 -2.45 28.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.572 1.549 . . . . 25.0 113.105 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -91.73 157.98 16.62 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.08 0.952 . . . . 25.0 110.657 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.24 138.05 39.68 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.27 1.428 . . . . 25.0 111.225 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -99.43 142.88 30.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.154 1.382 . . . . 25.0 107.459 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -159.93 173.83 15.32 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.551 0.691 . . . . 25.0 111.942 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -126.01 159.87 31.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.333 1.453 . . . . 25.0 110.374 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -54.19 134.35 44.53 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.321 1.848 . . . . 25.0 110.993 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.12 -11.27 69.46 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.348 1.452 . . . . 25.0 114.107 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -74.2 137.77 43.31 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 118.88 1.34 . . . . 25.0 109.998 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -100.2 153.58 19.15 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.735 0.814 . . . . 25.0 111.245 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -140.01 153.02 46.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.652 1.581 . . . . 25.0 112.238 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -105.35 131.26 53.02 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.643 1.977 . . . . 25.0 105.75 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.38 123.17 38.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.101 -0.703 . . . . 25.0 109.101 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -93.03 -44.62 8.31 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.873 0.869 . . . . 25.0 109.737 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.5 t-20 -156.05 130.04 8.6 Favored 'General case' 0 C--N 1.346 0.418 0 C-N-CA 123.652 0.781 . . . . 25.0 110.074 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.9 p -125.59 12.32 8.01 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.158 1.383 . . . . 25.0 114.584 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.1 p -93.9 -2.3 53.52 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.896 1.278 . . . . 25.0 113.04 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -86.19 15.53 5.12 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.518 1.527 . . . . 25.0 112.922 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.78 -158.19 18.56 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-O 121.506 0.503 . . . . 25.0 112.362 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -66.16 -12.14 53.93 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.488 1.515 . . . . 25.0 111.719 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.7 t-105 -101.57 114.61 28.79 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.374 1.869 . . . . 25.0 106.25 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -105.75 150.64 25.33 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 113.403 0.89 . . . . 25.0 113.403 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -96.87 129.38 44.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.541 1.936 . . . . 25.0 105.936 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.41 168.96 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 121.962 0.887 . . . . 25.0 112.671 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -125.88 128.67 47.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.033 2.133 . . . . 25.0 106.922 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 t -78.66 125.03 28.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.371 -0.974 . . . . 25.0 108.371 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.03 -17.15 61.47 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.352 0.661 . . . . 25.0 111.012 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 86.3 m -90.95 -46.21 8.3 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.09 1.356 . . . . 25.0 112.971 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.5 p -100.4 -21.97 15.21 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.514 1.301 . . . . 25.0 114.514 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.35 1.39 85.98 Favored Glycine 0 CA--C 1.537 1.455 0 CA-C-O 118.713 -1.048 . . . . 25.0 112.364 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -81.32 157.93 24.91 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 118.726 1.263 . . . . 25.0 110.727 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.8 p -119.65 144.89 46.92 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.129 0.972 . . . . 25.0 110.286 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.6 -168.37 38.82 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.212 1.387 . . . . 25.0 111.091 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -115.16 140.28 49.21 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.857 0.863 . . . . 25.0 110.706 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.7 pt -141.01 153.22 66.97 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.107 1.363 . . . . 25.0 109.743 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.35 122.89 9.69 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.359 2.706 . . . . 25.0 112.007 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 p -59.74 -36.6 41.17 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 116.11 -1.9 . . . . 25.0 115.205 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.08 -18.56 62.05 Favored 'Trans proline' 0 C--N 1.362 1.248 0 C-N-CA 122.627 2.218 . . . . 25.0 114.659 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.6 -2.31 38.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.205 1.002 . . . . 25.0 110.784 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.1 mt -118.19 158.48 25.03 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.035 1.334 . . . . 25.0 112.753 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.43 138.02 23.72 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.822 2.049 . . . . 25.0 108.304 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.68 138.36 49.07 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.955 2.436 . . . . 25.0 112.17 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.7 t -72.91 136.17 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.646 1.578 . . . . 25.0 108.076 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.253 1.259 0 CA-C-O 117.851 -1.071 . . . . 25.0 110.246 179.881 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.298 -0.26 . . . . 25.0 110.298 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.1 t -142.73 154.23 44.07 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.209 1.404 . . . . 25.0 110.243 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt -81.73 169.08 17.38 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.343 1.057 . . . . 25.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -130.4 146.48 51.97 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.551 1.541 . . . . 25.0 108.408 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -123.32 152.31 41.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.452 1.101 . . . . 25.0 110.937 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.15 134.89 37.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.824 1.65 . . . . 25.0 112.951 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.3 mt -89.6 -29.06 19.11 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.18 1.792 . . . . 25.0 111.909 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -153.8 162.75 40.97 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 125.752 1.621 . . . . 25.0 110.167 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.19 149.26 38.1 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.526 0.73 . . . . 25.0 109.93 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -146.79 135.82 22.47 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.979 0.912 . . . . 25.0 109.277 178.36 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -110.08 136.58 49.1 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.52 127.05 29.6 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.95 0.9 . . . . 25.0 109.534 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 -87.71 -22.23 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.075 0.95 . . . . 25.0 111.698 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -134.08 171.74 13.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.583 1.553 . . . . 25.0 110.214 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -69.03 -17.37 63.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.994 0.918 . . . . 25.0 111.903 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -96.66 -6.17 37.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.92 1.688 . . . . 25.0 112.444 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -94.83 157.86 15.74 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.564 1.146 . . . . 25.0 110.542 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 mt -106.92 139.85 40.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.229 1.412 . . . . 25.0 110.856 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.6 m -97.64 143.38 28.37 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -159.31 173.82 15.71 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.675 0.75 . . . . 25.0 111.382 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -124.3 158.98 31.28 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.362 1.465 . . . . 25.0 109.436 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.31 44.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 25.0 110.849 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.26 -9.27 72.28 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 125.157 1.361 . . . . 25.0 113.797 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.44 135.57 48.81 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.038 1.419 . . . . 25.0 109.631 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -99.75 151.8 20.83 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 121.559 0.695 . . . . 25.0 111.599 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -139.78 157.0 46.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.685 1.594 . . . . 25.0 112.832 -177.825 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -105.9 130.45 53.86 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 127.014 2.126 . . . . 25.0 105.439 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.8 mm -82.94 121.21 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.5 mt -92.79 -43.16 9.16 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.989 0.915 . . . . 25.0 108.741 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.3 t-20 -157.95 128.47 6.3 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 124.018 0.927 . . . . 25.0 109.516 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 82.4 p -125.61 12.4 8.01 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.407 1.632 . . . . 25.0 115.407 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -97.44 0.71 48.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.995 1.318 . . . . 25.0 114.243 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -88.16 15.98 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.205 1.402 . . . . 25.0 113.671 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.65 -157.89 18.69 Favored Glycine 0 C--N 1.344 1.027 0 N-CA-C 111.255 -0.738 . . . . 25.0 111.255 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.21 -7.26 28.76 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.351 1.06 . . . . 25.0 111.503 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.2 t-105 -103.12 111.64 24.1 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.26 1.824 . . . . 25.0 106.447 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -111.01 153.17 25.96 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.702 0.801 . . . . 25.0 112.736 -178.65 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -99.09 128.39 45.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.631 1.972 . . . . 25.0 106.178 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.5 m -142.86 169.73 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.079 0.942 . . . . 25.0 112.887 -179.19 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -124.85 126.9 46.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.247 2.219 . . . . 25.0 108.305 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.8 t -78.13 121.69 24.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.022 -1.473 . . . . 25.0 107.022 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.2 mt -78.54 -16.66 57.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.466 0.706 . . . . 25.0 111.19 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -88.67 -45.06 10.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.777 1.231 . . . . 25.0 111.725 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.6 p -95.82 -21.83 17.86 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.336 0.865 . . . . 25.0 113.336 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.07 1.04 89.77 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.085 -1.397 . . . . 25.0 112.832 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -89.85 164.55 14.57 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 119.342 1.571 . . . . 25.0 111.945 -178.764 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.6 p -120.48 147.76 44.71 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 125.071 1.348 . . . . 25.0 111.37 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.54 -168.42 38.93 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.948 1.261 . . . . 25.0 111.9 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -115.24 140.52 49.03 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.323 1.049 . . . . 25.0 110.299 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.0 pt -143.41 149.1 46.58 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.657 1.183 . . . . 25.0 109.236 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -68.7 124.43 11.51 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.867 3.045 . . . . 25.0 111.646 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.6 p -58.08 -35.45 33.95 Favored Pre-proline 0 CA--C 1.549 0.942 0 CA-C-O 115.719 -2.086 . . . . 25.0 116.392 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -64.31 -18.34 62.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 CA-C-N 123.394 2.248 . . . . 25.0 114.044 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.43 -3.63 47.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.742 0.817 . . . . 25.0 110.255 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.2 mt -119.78 158.83 25.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.94 1.696 . . . . 25.0 112.252 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.6 136.96 16.94 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.231 2.213 . . . . 25.0 107.275 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.73 145.85 87.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.735 2.29 . . . . 25.0 111.83 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.2 t -72.57 135.93 26.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 107.466 -1.309 . . . . 25.0 107.466 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 C--O 1.251 1.168 0 C-N-CA 127.369 2.267 . . . . 25.0 109.438 -179.714 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 119.327 -0.368 . . . . 25.0 110.098 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.3 t -143.66 151.98 40.78 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.94 1.296 . . . . 25.0 110.791 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.0 mt -82.08 166.2 19.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.525 1.13 . . . . 25.0 109.325 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -130.39 148.01 52.16 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.821 1.248 . . . . 25.0 109.154 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -126.25 156.07 40.88 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.616 1.166 . . . . 25.0 111.157 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.81 134.36 36.99 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.394 1.478 . . . . 25.0 112.68 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -87.77 -29.36 21.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.632 1.573 . . . . 25.0 112.143 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -154.69 165.79 35.45 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 126.099 1.759 . . . . 25.0 109.92 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.28 149.18 38.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.728 0.811 . . . . 25.0 110.654 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -149.58 135.92 19.1 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.543 1.137 . . . . 25.0 109.308 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -113.12 137.45 51.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.411 -1.7 . . . . 25.0 106.411 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.89 127.66 33.33 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.039 0.936 . . . . 25.0 111.019 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.0 mtp-105 -88.42 -22.93 23.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.334 1.453 . . . . 25.0 111.728 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.2 p -133.1 170.13 15.84 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 25.0 109.814 179.085 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.6 -18.6 63.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.364 0.666 . . . . 25.0 111.861 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -95.17 -6.55 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.735 1.614 . . . . 25.0 112.096 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -90.66 151.42 21.28 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.809 0.843 . . . . 25.0 110.75 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.3 mt -100.67 134.46 43.59 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.251 1.42 . . . . 25.0 109.222 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.9 m -91.65 142.78 27.24 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.936 -1.505 . . . . 25.0 106.936 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -154.15 168.04 27.84 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 121.654 0.74 . . . . 25.0 111.845 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -125.06 157.81 35.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.175 1.39 . . . . 25.0 108.755 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.18 134.15 44.44 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.355 1.062 . . . . 25.0 110.306 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.26 -8.87 69.72 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-O 118.302 -1.277 . . . . 25.0 113.732 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -69.93 132.22 45.63 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 119.147 1.474 . . . . 25.0 110.388 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -97.9 152.06 19.61 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.025 0.93 . . . . 25.0 110.556 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -140.68 155.4 46.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.736 1.214 . . . . 25.0 112.615 -178.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -106.01 130.19 53.98 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.16 122.3 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 123.368 0.667 . . . . 25.0 109.962 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.8 mt -99.58 -44.35 6.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.001 0.92 . . . . 25.0 110.06 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.8 t-20 -156.45 128.46 7.39 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.702 0.801 . . . . 25.0 110.824 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.7 m -125.7 12.54 7.97 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.057 1.343 . . . . 25.0 113.549 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.2 p -93.38 -2.69 54.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.101 0.961 . . . . 25.0 113.525 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -87.82 15.69 6.75 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.385 1.474 . . . . 25.0 113.415 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.94 18.63 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 118.526 0.603 . . . . 25.0 111.964 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -67.26 -9.6 42.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.902 1.281 . . . . 25.0 111.411 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -100.01 107.54 19.5 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 105.948 -1.871 . . . . 25.0 105.948 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m0 -105.13 151.78 23.61 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -98.67 128.03 44.8 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.225 -1.769 . . . . 25.0 106.225 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.6 m -141.62 168.81 14.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.574 0.75 . . . . 25.0 111.085 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.3 ttt-85 -117.73 123.77 46.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.875 -1.528 . . . . 25.0 106.875 177.023 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.5 t -75.62 116.39 16.29 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 105.941 -1.874 . . . . 25.0 105.941 178.657 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -77.66 -16.88 58.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.825 0.85 . . . . 25.0 111.536 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -87.87 -46.69 9.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 25.0 111.826 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.8 p -93.5 -20.71 20.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.45 0.907 . . . . 25.0 113.45 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.26 4.38 90.48 Favored Glycine 0 CA--C 1.538 1.489 0 CA-C-O 118.471 -1.183 . . . . 25.0 112.254 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.89 167.15 13.05 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 119.016 1.408 . . . . 25.0 111.688 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.4 p -121.76 145.12 48.36 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.297 1.439 . . . . 25.0 109.125 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.68 -168.31 38.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.85 0.738 . . . . 25.0 112.633 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -120.16 141.41 49.89 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.874 1.27 . . . . 25.0 111.032 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 pt -146.41 152.86 47.02 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.914 1.285 . . . . 25.0 110.087 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.51 123.47 10.54 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.435 2.756 . . . . 25.0 111.303 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.1 p -58.24 -35.7 36.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 CA-C-O 115.921 -1.99 . . . . 25.0 116.235 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.37 -18.43 63.09 Favored 'Trans proline' 0 C--N 1.361 1.208 0 CA-C-N 123.184 2.173 . . . . 25.0 114.432 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.15 -3.6 46.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.003 0.82 . . . . 25.0 110.702 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.6 mt -118.83 158.43 25.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.813 1.645 . . . . 25.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.29 138.13 26.3 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 127.036 2.134 . . . . 25.0 108.295 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.71 141.24 53.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.731 2.287 . . . . 25.0 111.913 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.75 135.89 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 107.288 -1.375 . . . . 25.0 107.288 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 126.124 1.77 . . . . 25.0 110.352 179.89 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 119.046 -0.502 . . . . 25.0 109.887 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -147.49 156.43 42.84 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.978 1.311 . . . . 25.0 110.814 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt -82.23 157.37 23.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.151 0.981 . . . . 25.0 108.824 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -130.38 148.99 52.26 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.734 1.214 . . . . 25.0 109.924 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.12 155.53 35.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.156 1.382 . . . . 25.0 110.127 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.88 130.78 35.22 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.872 1.269 . . . . 25.0 112.697 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.2 mt -89.34 -30.12 18.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 25.0 111.293 178.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -148.45 157.11 43.26 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 125.39 1.476 . . . . 25.0 110.152 -178.86 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -61.04 149.27 37.49 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.27 0.628 . . . . 25.0 110.288 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -144.3 137.31 27.11 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.72 1.208 . . . . 25.0 110.149 178.471 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -114.56 135.31 54.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.995 -1.484 . . . . 25.0 106.995 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.82 128.96 39.1 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.324 1.05 . . . . 25.0 111.314 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -83.87 -29.01 27.56 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.419 1.488 . . . . 25.0 112.038 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 p -132.12 171.66 13.36 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.205 1.402 . . . . 25.0 110.542 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.75 -17.21 64.01 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.019 0.927 . . . . 25.0 111.833 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -95.08 -5.13 45.0 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.149 1.78 . . . . 25.0 112.301 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -97.31 156.56 16.39 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.272 1.029 . . . . 25.0 111.479 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.3 mt -104.44 136.76 43.41 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.562 1.545 . . . . 25.0 110.659 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.6 m -95.02 145.47 24.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -154.67 169.53 23.67 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.822 0.82 . . . . 25.0 111.636 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -125.43 158.43 34.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.392 1.477 . . . . 25.0 108.932 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -54.3 134.21 45.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.763 1.225 . . . . 25.0 110.0 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.59 -11.52 68.37 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 125.06 1.314 . . . . 25.0 113.552 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.83 134.16 47.11 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 119.194 1.497 . . . . 25.0 110.032 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -100.95 154.02 19.03 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.562 0.745 . . . . 25.0 111.243 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -140.39 154.93 46.88 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.956 1.302 . . . . 25.0 113.737 -177.567 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -107.11 129.23 54.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 104.049 -2.575 . . . . 25.0 104.049 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.7 mm -81.36 121.11 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 123.197 0.599 . . . . 25.0 109.913 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -93.04 -42.5 9.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.229 1.012 . . . . 25.0 109.205 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 8.7 t-20 -157.06 126.87 6.22 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.985 0.914 . . . . 25.0 109.913 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.4 p -125.74 12.4 7.93 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.797 1.406 . . . . 25.0 114.797 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.0 p -96.47 -2.16 45.88 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.246 1.419 . . . . 25.0 114.391 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.53 16.31 6.75 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.13 1.372 . . . . 25.0 113.952 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.95 18.63 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 118.75 0.705 . . . . 25.0 112.831 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -67.86 -0.21 4.02 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.734 1.614 . . . . 25.0 112.071 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.6 t-105 -115.92 112.21 21.55 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.834 2.053 . . . . 25.0 106.166 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -110.11 154.12 23.74 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.013 0.925 . . . . 25.0 113.069 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -98.43 127.43 44.36 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 105.426 -2.065 . . . . 25.0 105.426 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.8 m -141.09 168.78 15.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.715 0.769 . . . . 25.0 111.694 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -121.42 123.2 41.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.565 1.546 . . . . 25.0 107.913 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.4 t -74.42 118.34 17.27 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.174 -2.158 . . . . 25.0 105.174 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.45 -12.45 60.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.521 0.728 . . . . 25.0 112.086 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.0 m -88.62 -43.83 11.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.897 1.279 . . . . 25.0 111.567 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 p -98.93 -21.05 16.46 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.987 1.106 . . . . 25.0 113.987 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.14 3.4 89.6 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 118.454 -1.192 . . . . 25.0 112.441 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -85.71 161.48 19.18 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.051 1.425 . . . . 25.0 111.354 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.0 p -120.6 145.32 47.5 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.873 1.269 . . . . 25.0 110.623 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.53 -168.25 38.67 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 124.541 1.067 . . . . 25.0 112.383 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.98 149.24 35.61 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.208 1.403 . . . . 25.0 111.746 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.0 pt -150.04 157.69 37.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.253 1.421 . . . . 25.0 111.003 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -71.26 122.13 8.42 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.978 2.452 . . . . 25.0 108.593 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.4 p -58.39 -35.19 30.59 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 116.953 2.205 . . . . 25.0 116.953 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -63.85 -16.21 53.51 Favored 'Trans proline' 0 C--N 1.36 1.184 0 C-N-CA 122.755 2.303 . . . . 25.0 115.199 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -77.83 -5.21 50.1 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.332 0.969 . . . . 25.0 111.817 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 33.0 mt -119.33 158.46 26.05 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.515 1.126 . . . . 25.0 112.274 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.25 143.26 32.84 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 127.596 2.358 . . . . 25.0 108.428 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -62.44 146.59 95.6 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.809 2.34 . . . . 25.0 111.272 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.46 135.85 26.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 123.971 0.909 . . . . 25.0 109.919 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.25 1.124 0 C-N-CA 127.174 2.189 . . . . 25.0 110.604 179.582 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.8 mt . . . . . 0 CA--C 1.535 0.374 0 N-CA-C 108.592 -0.892 . . . . 25.0 108.592 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -130.16 147.97 51.95 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.247 1.019 . . . . 25.0 109.366 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -121.5 152.65 38.93 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.092 1.357 . . . . 25.0 110.705 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.89 135.57 35.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.201 1.4 . . . . 25.0 113.366 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 86.1 mt -98.47 -24.56 15.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.064 1.745 . . . . 25.0 112.242 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.03 153.04 38.43 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.557 1.143 . . . . 25.0 110.527 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.1 149.22 37.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 109.332 -0.618 . . . . 25.0 109.332 175.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -146.61 137.23 23.93 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.719 0.807 . . . . 25.0 109.592 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -112.89 136.87 52.06 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 106.972 -1.492 . . . . 25.0 106.972 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.39 127.92 34.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.261 1.025 . . . . 25.0 110.068 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -93.59 -20.42 20.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.422 1.089 . . . . 25.0 112.338 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.0 p -130.07 171.27 13.0 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.027 1.331 . . . . 25.0 110.119 179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.06 -18.97 64.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.248 1.019 . . . . 25.0 112.366 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -101.96 -2.93 28.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.771 1.628 . . . . 25.0 112.815 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.0 156.06 18.24 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.28 0.945 . . . . 25.0 110.87 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 mt -107.22 140.47 40.04 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.314 1.446 . . . . 25.0 110.787 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.5 m -97.5 145.07 26.58 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.674 1.19 . . . . 25.0 107.834 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -156.82 170.81 21.62 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.714 0.769 . . . . 25.0 111.074 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -122.87 156.81 33.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.337 1.455 . . . . 25.0 108.727 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.21 44.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.702 1.201 . . . . 25.0 110.198 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.45 -9.54 66.93 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.343 1.449 . . . . 25.0 113.38 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.34 133.97 46.38 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.066 1.433 . . . . 25.0 110.19 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -102.05 152.62 20.76 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.69 0.796 . . . . 25.0 110.616 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.3 156.23 48.5 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.292 1.437 . . . . 25.0 112.822 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -107.45 128.98 54.97 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 104.648 -2.353 . . . . 25.0 104.648 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.5 mm -82.07 123.0 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.511 0.725 . . . . 25.0 110.995 -177.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.0 mt -91.45 -44.48 9.09 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.171 -1.048 . . . . 25.0 108.171 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -158.83 127.46 5.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.408 1.083 . . . . 25.0 108.948 178.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.2 p -125.62 12.5 8.01 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.6 p -93.28 5.32 51.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.524 1.13 . . . . 25.0 112.773 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -91.15 12.43 20.05 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.846 1.658 . . . . 25.0 114.711 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.66 -157.81 18.7 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 118.651 0.66 . . . . 25.0 111.529 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -69.47 -1.12 7.7 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.883 1.273 . . . . 25.0 111.717 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -112.15 105.74 14.17 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.52 1.928 . . . . 25.0 106.456 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -105.38 151.08 24.64 Favored 'General case' 0 C--N 1.345 0.385 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -96.02 126.37 41.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.472 -2.048 . . . . 25.0 105.472 177.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.1 m -142.86 168.28 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.933 0.873 . . . . 25.0 112.605 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -121.35 127.62 51.45 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.522 1.929 . . . . 25.0 107.738 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.7 t -76.54 119.66 20.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 106.788 -1.56 . . . . 25.0 106.788 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.4 mt -76.74 -15.9 59.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.334 0.654 . . . . 25.0 111.207 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.6 m -87.59 -46.08 9.86 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.146 1.378 . . . . 25.0 112.265 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.9 p -101.19 -21.05 15.03 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.472 1.286 . . . . 25.0 114.472 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.76 2.34 90.5 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.558 -1.134 . . . . 25.0 112.451 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -84.59 160.94 20.34 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-N 119.005 1.403 . . . . 25.0 110.871 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 37.0 p -121.07 144.28 48.63 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 124.461 1.104 . . . . 25.0 111.202 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.47 -168.46 39.03 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.478 1.037 . . . . 25.0 112.559 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -115.17 143.21 45.58 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 125.183 1.393 . . . . 25.0 111.006 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.3 pt -145.22 154.79 54.35 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 125.278 1.431 . . . . 25.0 109.82 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.43 122.63 9.39 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.911 2.407 . . . . 25.0 111.361 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.0 t -58.86 -36.99 48.69 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-O 116.154 -1.879 . . . . 25.0 115.042 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -63.63 -17.74 61.25 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.539 2.159 . . . . 25.0 114.684 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.64 -3.92 46.37 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.088 0.858 . . . . 25.0 110.343 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.5 mt -118.84 158.44 25.65 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.491 1.516 . . . . 25.0 112.371 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.78 141.88 36.76 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.13 2.172 . . . . 25.0 108.837 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.9 141.64 59.5 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.697 2.265 . . . . 25.0 111.113 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 87.6 t . . . . . 0 CA--C 1.535 0.375 0 C-N-CA 124.675 1.19 . . . . 25.0 108.19 179.154 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 58.0 mt . . . . . 0 CA--C 1.531 0.225 0 N-CA-C 109.407 -0.59 . . . . 25.0 109.407 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -131.95 157.1 44.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.112 1.365 . . . . 25.0 111.506 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -133.66 152.23 51.84 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.855 1.662 . . . . 25.0 110.142 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.76 133.1 37.13 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.741 1.616 . . . . 25.0 113.112 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.8 mt -94.46 -28.42 15.49 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.419 1.888 . . . . 25.0 112.391 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -146.58 155.22 42.32 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 124.757 1.223 . . . . 25.0 110.436 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -61.19 149.13 38.5 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.842 -0.799 . . . . 25.0 108.842 175.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -147.63 138.64 23.5 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 123.539 0.736 . . . . 25.0 109.996 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -116.97 137.67 52.07 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 107.731 -1.211 . . . . 25.0 107.731 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.3 130.59 46.89 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.309 1.044 . . . . 25.0 111.259 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -90.93 -26.19 19.41 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.48 1.112 . . . . 25.0 111.925 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.0 p -131.14 172.45 12.1 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.317 1.447 . . . . 25.0 110.437 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.64 -18.79 64.35 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.084 0.953 . . . . 25.0 112.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -94.86 -8.15 38.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.562 1.545 . . . . 25.0 112.3 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -94.27 156.67 16.41 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.332 1.053 . . . . 25.0 110.259 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 mt -112.11 141.43 45.79 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.83 1.252 . . . . 25.0 110.143 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.7 p -99.34 146.21 26.51 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.002 1.321 . . . . 25.0 108.126 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.23 175.68 13.13 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.801 0.81 . . . . 25.0 111.059 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -126.88 159.61 33.44 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.151 1.38 . . . . 25.0 108.532 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.19 134.31 44.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.609 1.164 . . . . 25.0 110.292 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.65 -11.27 62.9 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 125.234 1.397 . . . . 25.0 113.489 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -70.4 136.67 49.8 Favored 'General case' 0 C--N 1.347 0.483 0 CA-C-N 119.212 1.506 . . . . 25.0 109.452 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -101.67 150.05 23.51 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.84 0.829 . . . . 25.0 112.049 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -141.47 161.28 38.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.809 2.044 . . . . 25.0 111.295 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -121.51 137.87 54.54 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.459 2.303 . . . . 25.0 105.629 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -86.73 127.66 40.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 122.778 0.431 . . . . 25.0 110.603 -178.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.8 mt -97.47 -41.08 8.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.694 1.198 . . . . 25.0 109.85 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.0 130.85 9.15 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.917 0.887 . . . . 25.0 109.962 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.6 p -125.64 12.37 7.99 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.447 1.647 . . . . 25.0 115.447 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.4 p -95.11 0.22 54.08 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.866 1.267 . . . . 25.0 113.225 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -88.84 16.12 7.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.746 1.618 . . . . 25.0 113.433 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.86 -158.18 18.5 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 118.497 0.59 . . . . 25.0 112.869 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.64 -7.72 35.68 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.298 1.439 . . . . 25.0 112.19 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -111.57 123.08 49.5 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 105.691 -1.966 . . . . 25.0 105.691 177.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.29 157.0 21.48 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.221 1.193 . . . . 25.0 114.221 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.85 131.97 41.61 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.58 1.952 . . . . 25.0 106.283 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.9 m -139.19 167.76 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.538 1.161 . . . . 25.0 113.922 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -125.65 114.76 19.12 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.738 2.815 . . . . 25.0 104.919 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.8 t -74.99 121.92 22.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.463 -0.94 . . . . 25.0 108.463 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.73 -21.25 55.55 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.135 0.974 . . . . 25.0 111.418 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.0 m -88.21 -46.01 9.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.616 1.166 . . . . 25.0 112.179 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.1 p -93.89 -21.53 19.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.477 0.917 . . . . 25.0 113.477 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.45 0.62 87.39 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 118.337 -1.257 . . . . 25.0 112.558 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -90.36 166.9 13.03 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.037 1.419 . . . . 25.0 111.789 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 p -122.7 145.47 48.36 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.878 1.271 . . . . 25.0 110.513 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.67 -168.41 38.84 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.579 1.085 . . . . 25.0 112.117 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -116.27 137.32 52.24 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.974 1.31 . . . . 25.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.8 pt -144.92 155.29 55.66 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.915 1.286 . . . . 25.0 110.651 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.08 123.96 10.87 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.981 3.121 . . . . 25.0 112.941 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 p -59.46 -36.23 38.57 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-O 115.852 -2.023 . . . . 25.0 115.955 178.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.98 -18.73 63.0 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 123.322 2.222 . . . . 25.0 114.376 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -79.56 -3.77 48.4 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.906 0.775 . . . . 25.0 110.938 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.0 mt -119.54 158.2 26.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.087 1.355 . . . . 25.0 112.38 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -142.3 141.09 20.19 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 127.452 2.301 . . . . 25.0 107.967 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.23 146.16 89.89 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.581 2.187 . . . . 25.0 112.229 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t . . . . . 0 CA--C 1.534 0.34 0 C-N-CA 125.085 1.354 . . . . 25.0 108.397 179.688 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.7 mt . . . . . 0 CA--C 1.53 0.206 0 CA-C-O 121.202 0.525 . . . . 25.0 110.15 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -130.34 150.16 51.7 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.907 1.683 . . . . 25.0 107.194 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -127.34 148.07 50.25 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.354 1.062 . . . . 25.0 110.693 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.41 132.49 37.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.192 1.397 . . . . 25.0 112.212 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.9 mt -89.5 -28.74 19.44 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.338 1.855 . . . . 25.0 112.301 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -151.65 158.71 43.82 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.861 1.264 . . . . 25.0 110.618 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -61.19 149.11 38.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.3 0.64 . . . . 25.0 109.863 176.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -147.06 135.11 21.47 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 123.907 0.883 . . . . 25.0 109.878 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -113.57 136.98 52.22 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.02 128.73 38.28 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.554 1.141 . . . . 25.0 111.083 -179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -82.68 -25.83 32.65 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.789 1.236 . . . . 25.0 111.599 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -130.94 168.92 16.53 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.385 1.474 . . . . 25.0 109.98 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.04 -15.83 63.77 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.2 1.0 . . . . 25.0 112.825 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -101.31 -2.64 30.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.778 1.631 . . . . 25.0 113.018 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -94.84 156.79 16.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.562 1.145 . . . . 25.0 110.187 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 mt -97.43 136.24 38.16 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.738 1.215 . . . . 25.0 111.493 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.0 m -98.61 144.02 28.37 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -158.34 173.12 17.15 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.932 0.872 . . . . 25.0 111.438 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -126.43 159.17 34.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.329 1.452 . . . . 25.0 108.572 178.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.17 134.26 44.36 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.75 1.22 . . . . 25.0 110.208 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.33 -10.22 65.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.148 1.356 . . . . 25.0 113.462 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.13 138.07 51.61 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 119.255 1.527 . . . . 25.0 110.057 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -102.63 150.76 23.11 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.409 0.684 . . . . 25.0 111.764 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -138.05 159.49 41.89 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.132 1.373 . . . . 25.0 113.682 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -112.75 125.53 54.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.38 -2.822 . . . . 25.0 103.38 176.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 mm -85.43 122.53 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.398 -0.964 . . . . 25.0 108.398 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.4 mt -90.19 -41.94 11.32 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.051 0.94 . . . . 25.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.57 126.74 5.86 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.841 0.857 . . . . 25.0 109.882 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p -125.69 12.34 7.96 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 114.818 1.414 . . . . 25.0 114.818 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.0 p -93.52 -0.86 56.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.896 1.278 . . . . 25.0 113.364 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -89.58 14.22 12.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.4 1.48 . . . . 25.0 113.761 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.82 -157.88 18.58 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 118.621 0.646 . . . . 25.0 112.796 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -66.35 -6.85 15.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.807 1.643 . . . . 25.0 112.417 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.5 t-105 -109.25 113.49 26.37 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 106.412 -1.699 . . . . 25.0 106.412 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -107.86 153.97 22.25 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.587 0.958 . . . . 25.0 113.587 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -98.63 126.77 44.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.268 2.227 . . . . 25.0 105.162 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.1 m -141.35 170.67 13.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.265 1.031 . . . . 25.0 112.978 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -128.73 125.09 37.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 127.637 2.375 . . . . 25.0 108.079 176.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 t -77.7 122.63 25.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 106.753 -1.573 . . . . 25.0 106.753 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.8 mt -78.56 -16.72 57.11 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.597 0.759 . . . . 25.0 111.694 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.9 m -86.68 -43.23 12.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.572 1.149 . . . . 25.0 111.542 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -98.05 -21.8 16.6 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.438 0.903 . . . . 25.0 113.438 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.02 1.74 87.95 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-O 118.297 -1.28 . . . . 25.0 112.499 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -88.04 165.12 15.39 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 119.02 1.41 . . . . 25.0 111.729 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.7 p -122.22 149.14 44.08 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.026 1.331 . . . . 25.0 111.851 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.64 -168.6 39.15 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 125.338 1.447 . . . . 25.0 111.864 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -116.39 142.72 46.49 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.486 1.114 . . . . 25.0 109.966 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.7 pt -145.43 157.56 52.29 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 124.897 1.279 . . . . 25.0 110.659 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.99 124.37 10.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.793 2.995 . . . . 25.0 110.367 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.0 p -57.51 -35.93 40.21 Favored Pre-proline 0 CA--C 1.55 0.948 0 N-CA-C 117.174 2.287 . . . . 25.0 117.174 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.25 -16.0 52.65 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.819 2.346 . . . . 25.0 114.871 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -78.34 -5.41 52.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.094 -0.955 . . . . 25.0 112.103 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.4 mt -119.47 157.98 27.18 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 124.175 0.99 . . . . 25.0 111.433 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.53 138.14 17.12 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 126.653 1.981 . . . . 25.0 108.787 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.75 146.94 80.29 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.85 2.367 . . . . 25.0 111.568 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.0 t . . . . . 0 CA--C 1.533 0.314 0 C-N-CA 124.686 1.194 . . . . 25.0 108.39 179.741 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 71.8 mt . . . . . 0 CA--C 1.534 0.331 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -122.85 145.7 48.21 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 123.675 0.79 . . . . 25.0 109.713 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -123.82 151.42 43.4 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.629 1.572 . . . . 25.0 110.195 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.01 134.8 36.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.956 1.302 . . . . 25.0 113.236 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.54 -26.56 17.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.284 1.434 . . . . 25.0 111.599 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -147.71 156.35 42.67 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.978 1.311 . . . . 25.0 110.344 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.08 149.16 37.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.083 0.553 . . . . 25.0 109.782 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -148.16 137.9 22.38 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.226 1.01 . . . . 25.0 109.946 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -114.34 138.8 50.07 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.152 -1.425 . . . . 25.0 107.152 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.98 128.36 36.47 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.49 1.116 . . . . 25.0 111.076 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -85.94 -25.16 26.24 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.932 1.293 . . . . 25.0 112.087 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 43.9 p -130.48 170.83 13.71 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.018 1.327 . . . . 25.0 110.211 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -68.1 -17.31 64.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.151 0.98 . . . . 25.0 112.487 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.18 -3.12 27.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.645 1.578 . . . . 25.0 112.635 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.7 156.77 17.34 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.258 1.023 . . . . 25.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.7 mt -104.55 137.67 42.05 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.099 1.36 . . . . 25.0 111.442 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.7 m -96.73 145.75 25.51 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.158 1.383 . . . . 25.0 107.87 177.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -158.6 171.11 20.72 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 122.048 0.928 . . . . 25.0 111.859 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -123.09 159.71 27.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.048 1.739 . . . . 25.0 108.053 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.23 134.06 44.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.25 1.02 . . . . 25.0 109.829 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.6 -9.31 68.92 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.06 -1.411 . . . . 25.0 114.129 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -69.74 135.82 50.22 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 119.544 1.672 . . . . 25.0 110.108 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -99.78 151.07 21.67 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.579 0.752 . . . . 25.0 112.255 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -141.83 157.28 45.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.495 1.918 . . . . 25.0 111.675 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -116.14 134.6 54.76 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.695 1.998 . . . . 25.0 106.302 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.5 mm -82.47 126.64 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.645 0.778 . . . . 25.0 111.484 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -98.95 -42.85 6.94 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.585 1.154 . . . . 25.0 108.873 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.68 125.69 5.4 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 124.524 1.13 . . . . 25.0 109.177 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.3 p -125.68 12.47 7.97 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.317 1.599 . . . . 25.0 115.317 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.9 p -92.61 1.19 57.4 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.863 1.265 . . . . 25.0 113.42 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -90.22 16.13 9.15 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.618 1.567 . . . . 25.0 113.595 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.81 -157.9 18.58 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 118.705 0.684 . . . . 25.0 111.946 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.43 -5.43 19.17 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.069 1.348 . . . . 25.0 111.627 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -106.1 110.13 22.29 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.236 1.815 . . . . 25.0 106.358 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -107.68 149.49 28.06 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 113.362 0.875 . . . . 25.0 113.362 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -95.41 128.05 41.95 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.703 2.001 . . . . 25.0 105.719 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -141.74 170.5 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 122.23 1.014 . . . . 25.0 112.927 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -123.66 125.86 45.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 127.346 2.258 . . . . 25.0 106.38 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -76.71 119.66 20.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.492 -1.299 . . . . 25.0 107.492 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.4 mt -74.87 -18.72 60.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.541 0.736 . . . . 25.0 111.641 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.7 m -91.03 -44.5 9.27 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.395 1.078 . . . . 25.0 112.738 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.2 p -99.05 -21.39 16.23 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.29 1.219 . . . . 25.0 114.29 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.55 1.2 90.05 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.352 -1.249 . . . . 25.0 112.576 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.41 160.69 20.56 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.081 1.441 . . . . 25.0 110.943 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 p -120.2 144.31 47.79 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.315 1.046 . . . . 25.0 110.805 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.57 -168.34 38.79 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.519 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -114.93 141.58 47.76 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 125.159 1.384 . . . . 25.0 110.759 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 pt -144.17 150.56 49.16 Favored Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.27 1.428 . . . . 25.0 109.536 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.68 122.89 9.58 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.546 2.83 . . . . 25.0 111.647 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.8 p -59.35 -36.17 38.46 Favored Pre-proline 0 CA--C 1.548 0.893 0 CA-C-O 116.049 -1.929 . . . . 25.0 115.813 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -64.62 -18.59 63.23 Favored 'Trans proline' 0 C--N 1.362 1.248 0 CA-C-N 123.101 2.143 . . . . 25.0 114.624 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -79.32 -4.08 49.15 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.759 0.823 . . . . 25.0 111.0 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.5 mt -118.73 158.45 25.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.25 1.42 . . . . 25.0 112.907 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.79 144.79 43.17 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.572 2.349 . . . . 25.0 108.125 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.25 147.15 91.11 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.829 2.353 . . . . 25.0 111.573 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.5 t . . . . . 0 CA--C 1.533 0.303 0 C-N-CA 124.899 1.28 . . . . 25.0 108.798 179.862 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 mt . . . . . 0 CA--C 1.531 0.249 0 CA-C-O 120.853 0.358 . . . . 25.0 110.101 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -131.14 151.39 51.5 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.195 1.398 . . . . 25.0 109.716 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -126.2 153.03 45.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 25.0 110.363 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.81 131.14 35.37 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.362 1.465 . . . . 25.0 112.505 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.8 mt -89.43 -30.41 18.34 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.684 1.594 . . . . 25.0 111.523 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -153.06 163.9 38.99 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.232 1.813 . . . . 25.0 109.681 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.12 149.14 38.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.948 0.899 . . . . 25.0 111.458 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -145.19 137.09 25.6 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.128 1.371 . . . . 25.0 109.628 178.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -113.01 134.88 54.31 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.696 -1.224 . . . . 25.0 107.696 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.97 129.12 39.81 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.446 1.098 . . . . 25.0 109.964 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -93.76 -21.46 19.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.023 0.929 . . . . 25.0 112.567 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.8 p -129.86 171.1 13.08 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.884 1.274 . . . . 25.0 110.36 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.19 -18.36 63.91 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.033 0.933 . . . . 25.0 111.918 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -97.41 -3.64 39.79 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.88 1.672 . . . . 25.0 112.264 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -94.87 158.49 15.46 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.313 1.045 . . . . 25.0 111.296 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.5 mt -111.97 140.11 46.9 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.297 1.439 . . . . 25.0 109.998 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.4 m -95.85 145.8 25.07 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 107.582 -1.266 . . . . 25.0 107.582 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -155.24 169.45 24.14 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 122.021 0.915 . . . . 25.0 110.942 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -123.14 160.4 26.55 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.432 1.493 . . . . 25.0 108.228 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -54.31 134.14 45.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.76 1.224 . . . . 25.0 109.881 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.84 -11.28 68.12 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 125.115 1.34 . . . . 25.0 113.837 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -71.5 137.75 48.4 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 119.376 1.588 . . . . 25.0 110.064 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -106.75 153.27 22.69 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-O 121.781 0.801 . . . . 25.0 112.218 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -140.51 157.91 44.79 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.654 1.982 . . . . 25.0 112.532 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -113.85 136.16 53.17 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 105.105 -2.183 . . . . 25.0 105.105 177.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 46.5 mm -82.25 124.36 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.457 0.703 . . . . 25.0 111.199 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 47.9 mt -90.92 -44.03 9.62 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -159.87 129.92 5.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.507 1.123 . . . . 25.0 109.09 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.2 p -125.51 12.45 8.07 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 115.722 1.749 . . . . 25.0 115.722 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.6 p -95.18 5.32 52.12 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.65 1.18 . . . . 25.0 112.718 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -88.51 13.91 10.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.23 1.812 . . . . 25.0 113.788 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.62 -158.0 18.69 Favored Glycine 0 C--N 1.343 0.934 0 N-CA-C 111.633 -0.587 . . . . 25.0 111.633 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -67.85 -7.18 25.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.914 1.286 . . . . 25.0 111.365 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -107.6 116.14 31.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.984 2.114 . . . . 25.0 106.382 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -111.7 153.83 25.87 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.473 0.916 . . . . 25.0 113.473 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -97.28 130.49 44.46 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 126.879 2.072 . . . . 25.0 106.041 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.5 m -140.14 166.74 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 122.256 1.027 . . . . 25.0 113.678 -178.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 -125.37 122.82 37.89 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.309 2.244 . . . . 25.0 105.827 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.8 t -76.33 123.14 25.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.803 -0.814 . . . . 25.0 108.803 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.17 -19.43 58.46 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.847 0.859 . . . . 25.0 110.975 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.3 m -88.32 -45.92 9.62 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.165 1.386 . . . . 25.0 112.491 -179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.8 p -97.63 -21.55 16.98 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.915 1.08 . . . . 25.0 113.915 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.33 1.81 88.69 Favored Glycine 0 CA--C 1.538 1.482 0 CA-C-O 118.419 -1.211 . . . . 25.0 112.608 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -87.54 167.18 14.17 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 118.974 1.387 . . . . 25.0 111.417 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 51.3 p -121.0 145.34 47.87 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.771 1.228 . . . . 25.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.56 -168.46 38.99 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.453 1.025 . . . . 25.0 112.646 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -117.19 142.93 46.42 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.914 1.286 . . . . 25.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.4 pt -146.23 150.56 41.84 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.807 1.243 . . . . 25.0 110.283 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.29 123.39 10.21 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.89 3.06 . . . . 25.0 111.464 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.5 p -58.97 -35.84 36.47 Favored Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 116.589 2.07 . . . . 25.0 116.589 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -64.84 -18.53 62.66 Favored 'Trans proline' 0 C--N 1.361 1.207 0 CA-C-N 123.277 2.206 . . . . 25.0 114.797 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.87 -4.18 48.36 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.04 0.836 . . . . 25.0 110.716 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.1 mt -119.82 159.25 24.94 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 125.749 1.62 . . . . 25.0 112.6 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.8 139.46 30.75 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.852 2.061 . . . . 25.0 107.98 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.28 142.52 73.48 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.541 2.161 . . . . 25.0 110.046 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 86.1 t . . . . . 0 CA--C 1.533 0.313 0 C-N-CA 123.73 0.812 . . . . 25.0 108.945 -179.596 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.0 mt . . . . . 0 CA--C 1.536 0.409 0 N-CA-C 108.723 -0.843 . . . . 25.0 108.723 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -131.29 148.39 52.68 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.33 1.052 . . . . 25.0 109.979 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -125.58 155.54 40.53 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.077 1.351 . . . . 25.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.01 133.55 37.96 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.329 1.452 . . . . 25.0 113.624 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.08 -29.34 18.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.265 1.826 . . . . 25.0 112.071 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -152.04 161.5 42.53 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 125.723 1.609 . . . . 25.0 110.093 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -61.04 149.22 37.63 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.984 0.514 . . . . 25.0 109.795 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -145.51 138.58 26.2 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.179 0.991 . . . . 25.0 110.308 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -117.15 135.28 53.88 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.181 -1.414 . . . . 25.0 107.181 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.46 131.18 49.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.077 1.351 . . . . 25.0 111.65 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.2 mtp-105 -83.2 -29.36 28.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 25.0 111.628 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.3 p -131.61 173.62 10.94 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.202 1.401 . . . . 25.0 111.418 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -68.04 -18.65 64.75 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.107 1.363 . . . . 25.0 112.705 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -97.3 -6.33 34.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.463 1.505 . . . . 25.0 112.421 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -95.3 155.95 16.52 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.876 1.27 . . . . 25.0 109.305 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.0 mt -109.95 143.41 39.95 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 124.487 1.115 . . . . 25.0 110.796 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 70.1 m -96.8 147.8 23.56 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.11 1.364 . . . . 25.0 108.116 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -156.07 170.0 23.2 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.755 0.788 . . . . 25.0 111.226 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -120.7 157.24 30.07 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.263 1.425 . . . . 25.0 108.488 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -54.23 134.18 44.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.845 1.258 . . . . 25.0 110.4 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.62 -8.48 68.69 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 125.25 1.405 . . . . 25.0 113.752 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -70.34 133.14 46.65 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 119.168 1.484 . . . . 25.0 110.681 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -97.79 152.69 18.89 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 123.778 0.831 . . . . 25.0 110.971 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -140.29 154.51 46.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.536 1.534 . . . . 25.0 111.564 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -110.14 130.04 55.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 104.53 -2.396 . . . . 25.0 104.53 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -82.9 125.4 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 123.148 0.579 . . . . 25.0 111.009 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.1 mt -95.27 -41.85 8.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.606 1.162 . . . . 25.0 109.341 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -158.58 129.09 6.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.566 1.146 . . . . 25.0 109.401 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 79.8 p -125.6 12.38 8.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.491 1.664 . . . . 25.0 115.491 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.6 p -94.19 2.44 55.93 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.684 1.193 . . . . 25.0 113.298 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -88.57 14.56 9.64 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.689 1.596 . . . . 25.0 114.036 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.67 -158.02 18.66 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 118.533 0.606 . . . . 25.0 112.706 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.4 -2.9 9.5 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.641 1.576 . . . . 25.0 112.258 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.4 t-105 -117.43 120.2 37.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 105.573 -2.01 . . . . 25.0 105.573 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.16 157.54 20.73 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 114.695 1.368 . . . . 25.0 114.695 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -96.97 125.24 41.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.353 2.261 . . . . 25.0 105.346 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.43 171.53 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 122.148 0.975 . . . . 25.0 112.786 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -122.51 125.74 46.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.393 2.277 . . . . 25.0 108.012 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -77.87 119.16 20.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.245 -1.761 . . . . 25.0 106.245 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.86 -17.44 59.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.737 0.815 . . . . 25.0 112.057 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.5 m -84.08 -44.47 14.04 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.747 1.219 . . . . 25.0 112.217 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -100.61 -19.33 16.16 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.023 1.12 . . . . 25.0 114.023 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.12 1.86 88.29 Favored Glycine 0 CA--C 1.539 1.536 0 CA-C-O 118.608 -1.107 . . . . 25.0 112.164 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -83.06 167.15 18.14 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 118.776 1.288 . . . . 25.0 111.153 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 38.3 p -125.05 147.85 48.78 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.707 1.203 . . . . 25.0 110.462 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.82 -168.55 38.97 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.49 1.043 . . . . 25.0 112.044 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -120.12 140.35 51.21 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.418 1.087 . . . . 25.0 110.338 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.0 pt -147.24 156.6 46.41 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.176 1.39 . . . . 25.0 110.793 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.16 123.13 9.98 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.903 3.069 . . . . 25.0 112.755 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 p -59.94 -35.47 28.92 Favored Pre-proline 0 CA--C 1.551 1.016 0 CA-C-O 115.785 -2.055 . . . . 25.0 115.509 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.3 -18.98 65.15 Favored 'Trans proline' 0 C--N 1.363 1.312 0 CA-C-N 123.488 2.281 . . . . 25.0 114.245 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -79.12 -3.12 43.89 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 119.064 0.847 . . . . 25.0 110.335 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 46.2 mt -119.13 158.18 26.43 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.831 1.653 . . . . 25.0 111.494 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.41 142.74 35.89 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.133 2.173 . . . . 25.0 108.478 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.61 145.95 92.06 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.738 2.292 . . . . 25.0 111.03 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.9 t . . . . . 0 CA--C 1.533 0.309 0 C-N-CA 124.115 0.966 . . . . 25.0 108.468 -179.843 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.5 mt . . . . . 0 C--O 1.232 0.143 0 CA-C-O 121.427 0.632 . . . . 25.0 111.361 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -134.63 148.21 50.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.382 1.873 . . . . 25.0 107.671 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -127.46 153.38 46.36 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.628 0.771 . . . . 25.0 111.655 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.57 132.76 42.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.051 1.74 . . . . 25.0 112.495 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -91.8 -28.75 17.16 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.976 1.71 . . . . 25.0 111.887 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -150.86 160.15 44.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.734 1.614 . . . . 25.0 109.652 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -61.04 149.17 37.79 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.717 -0.475 . . . . 25.0 109.717 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -146.55 135.72 22.66 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 124.179 0.991 . . . . 25.0 108.927 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -114.54 139.32 49.68 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.6 126.83 29.15 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.564 1.145 . . . . 25.0 110.558 -179.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -86.46 -24.26 25.69 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.742 1.217 . . . . 25.0 111.727 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -129.3 170.11 14.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.454 1.502 . . . . 25.0 109.977 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.78 -16.83 64.31 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.462 1.105 . . . . 25.0 113.02 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.74 -2.45 28.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.572 1.549 . . . . 25.0 113.105 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -91.73 157.98 16.62 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.08 0.952 . . . . 25.0 110.657 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.24 138.05 39.68 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.27 1.428 . . . . 25.0 111.225 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -99.43 142.88 30.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.154 1.382 . . . . 25.0 107.459 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -159.93 173.83 15.32 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.551 0.691 . . . . 25.0 111.942 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -126.01 159.87 31.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.333 1.453 . . . . 25.0 110.374 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -54.19 134.35 44.53 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.321 1.848 . . . . 25.0 110.993 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.12 -11.27 69.46 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.348 1.452 . . . . 25.0 114.107 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -74.2 137.77 43.31 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 118.88 1.34 . . . . 25.0 109.998 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -100.2 153.58 19.15 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.735 0.814 . . . . 25.0 111.245 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -140.01 153.02 46.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.652 1.581 . . . . 25.0 112.238 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -105.35 131.26 53.02 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.643 1.977 . . . . 25.0 105.75 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.38 123.17 38.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.101 -0.703 . . . . 25.0 109.101 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -93.03 -44.62 8.31 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.873 0.869 . . . . 25.0 109.737 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.05 130.04 8.6 Favored 'General case' 0 C--N 1.346 0.418 0 C-N-CA 123.652 0.781 . . . . 25.0 110.074 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.9 p -125.59 12.32 8.01 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.158 1.383 . . . . 25.0 114.584 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.1 p -93.9 -2.3 53.52 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.896 1.278 . . . . 25.0 113.04 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -86.19 15.53 5.12 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.518 1.527 . . . . 25.0 112.922 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.78 -158.19 18.56 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-O 121.506 0.503 . . . . 25.0 112.362 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -66.16 -12.14 53.93 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.488 1.515 . . . . 25.0 111.719 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.7 t-105 -101.57 114.61 28.79 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.374 1.869 . . . . 25.0 106.25 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -105.75 150.64 25.33 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 113.403 0.89 . . . . 25.0 113.403 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -96.87 129.38 44.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.541 1.936 . . . . 25.0 105.936 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.41 168.96 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 121.962 0.887 . . . . 25.0 112.671 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -125.88 128.67 47.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.033 2.133 . . . . 25.0 106.922 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 t -78.66 125.03 28.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.371 -0.974 . . . . 25.0 108.371 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.03 -17.15 61.47 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.352 0.661 . . . . 25.0 111.012 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 86.3 m -90.95 -46.21 8.3 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.09 1.356 . . . . 25.0 112.971 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.5 p -100.4 -21.97 15.21 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.514 1.301 . . . . 25.0 114.514 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.35 1.39 85.98 Favored Glycine 0 CA--C 1.537 1.455 0 CA-C-O 118.713 -1.048 . . . . 25.0 112.364 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -81.32 157.93 24.91 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 118.726 1.263 . . . . 25.0 110.727 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.8 p -119.65 144.89 46.92 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.129 0.972 . . . . 25.0 110.286 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.6 -168.37 38.82 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.212 1.387 . . . . 25.0 111.091 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -115.16 140.28 49.21 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.857 0.863 . . . . 25.0 110.706 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.7 pt -141.01 153.22 66.97 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.107 1.363 . . . . 25.0 109.743 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.35 122.89 9.69 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.359 2.706 . . . . 25.0 112.007 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 p -59.74 -36.6 41.17 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 116.11 -1.9 . . . . 25.0 115.205 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.08 -18.56 62.05 Favored 'Trans proline' 0 C--N 1.362 1.248 0 C-N-CA 122.627 2.218 . . . . 25.0 114.659 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.6 -2.31 38.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.205 1.002 . . . . 25.0 110.784 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.1 mt -118.19 158.48 25.03 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.035 1.334 . . . . 25.0 112.753 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.43 138.02 23.72 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.822 2.049 . . . . 25.0 108.304 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.68 138.36 49.07 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.955 2.436 . . . . 25.0 112.17 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.7 t . . . . . 0 CA--C 1.535 0.401 0 C-N-CA 125.646 1.578 . . . . 25.0 108.076 178.437 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt . . . . . 0 CA--C 1.535 0.374 0 CA-C-O 120.936 0.398 . . . . 25.0 110.056 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -130.4 146.48 51.97 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.551 1.541 . . . . 25.0 108.408 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -123.32 152.31 41.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.452 1.101 . . . . 25.0 110.937 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.15 134.89 37.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.824 1.65 . . . . 25.0 112.951 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.3 mt -89.6 -29.06 19.11 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.18 1.792 . . . . 25.0 111.909 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -153.8 162.75 40.97 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 125.752 1.621 . . . . 25.0 110.167 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.19 149.26 38.1 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.526 0.73 . . . . 25.0 109.93 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -146.79 135.82 22.47 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.979 0.912 . . . . 25.0 109.277 178.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -110.08 136.58 49.1 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.52 127.05 29.6 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.95 0.9 . . . . 25.0 109.534 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 -87.71 -22.23 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.075 0.95 . . . . 25.0 111.698 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -134.08 171.74 13.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.583 1.553 . . . . 25.0 110.214 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -69.03 -17.37 63.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.994 0.918 . . . . 25.0 111.903 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -96.66 -6.17 37.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.92 1.688 . . . . 25.0 112.444 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -94.83 157.86 15.74 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.564 1.146 . . . . 25.0 110.542 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 mt -106.92 139.85 40.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.229 1.412 . . . . 25.0 110.856 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.6 m -97.64 143.38 28.37 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -159.31 173.82 15.71 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.675 0.75 . . . . 25.0 111.382 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -124.3 158.98 31.28 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.362 1.465 . . . . 25.0 109.436 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.31 44.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 25.0 110.849 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.26 -9.27 72.28 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 125.157 1.361 . . . . 25.0 113.797 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.44 135.57 48.81 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.038 1.419 . . . . 25.0 109.631 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -99.75 151.8 20.83 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 121.559 0.695 . . . . 25.0 111.599 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -139.78 157.0 46.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.685 1.594 . . . . 25.0 112.832 -177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -105.9 130.45 53.86 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 127.014 2.126 . . . . 25.0 105.439 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.8 mm -82.94 121.21 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.5 mt -92.79 -43.16 9.16 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.989 0.915 . . . . 25.0 108.741 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.95 128.47 6.3 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 124.018 0.927 . . . . 25.0 109.516 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 82.4 p -125.61 12.4 8.01 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.407 1.632 . . . . 25.0 115.407 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -97.44 0.71 48.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.995 1.318 . . . . 25.0 114.243 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -88.16 15.98 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.205 1.402 . . . . 25.0 113.671 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.65 -157.89 18.69 Favored Glycine 0 C--N 1.344 1.027 0 N-CA-C 111.255 -0.738 . . . . 25.0 111.255 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.21 -7.26 28.76 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.351 1.06 . . . . 25.0 111.503 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.2 t-105 -103.12 111.64 24.1 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.26 1.824 . . . . 25.0 106.447 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -111.01 153.17 25.96 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.702 0.801 . . . . 25.0 112.736 -178.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -99.09 128.39 45.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.631 1.972 . . . . 25.0 106.178 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.5 m -142.86 169.73 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.079 0.942 . . . . 25.0 112.887 -179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -124.85 126.9 46.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.247 2.219 . . . . 25.0 108.305 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.8 t -78.13 121.69 24.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.022 -1.473 . . . . 25.0 107.022 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.2 mt -78.54 -16.66 57.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.466 0.706 . . . . 25.0 111.19 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -88.67 -45.06 10.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.777 1.231 . . . . 25.0 111.725 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.6 p -95.82 -21.83 17.86 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.336 0.865 . . . . 25.0 113.336 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.07 1.04 89.77 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.085 -1.397 . . . . 25.0 112.832 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -89.85 164.55 14.57 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 119.342 1.571 . . . . 25.0 111.945 -178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.6 p -120.48 147.76 44.71 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 125.071 1.348 . . . . 25.0 111.37 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.54 -168.42 38.93 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.948 1.261 . . . . 25.0 111.9 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -115.24 140.52 49.03 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.323 1.049 . . . . 25.0 110.299 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.0 pt -143.41 149.1 46.58 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.657 1.183 . . . . 25.0 109.236 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -68.7 124.43 11.51 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.867 3.045 . . . . 25.0 111.646 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.6 p -58.08 -35.45 33.95 Favored Pre-proline 0 CA--C 1.549 0.942 0 CA-C-O 115.719 -2.086 . . . . 25.0 116.392 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -64.31 -18.34 62.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 CA-C-N 123.394 2.248 . . . . 25.0 114.044 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.43 -3.63 47.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.742 0.817 . . . . 25.0 110.255 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.2 mt -119.78 158.83 25.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.94 1.696 . . . . 25.0 112.252 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.6 136.96 16.94 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.231 2.213 . . . . 25.0 107.275 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.73 145.85 87.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.735 2.29 . . . . 25.0 111.83 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.2 t . . . . . 0 CA--C 1.534 0.362 0 N-CA-C 107.466 -1.309 . . . . 25.0 107.466 179.12 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.0 mt . . . . . 0 CA--C 1.534 0.348 0 N-CA-C 109.325 -0.62 . . . . 25.0 109.325 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -130.39 148.01 52.16 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.821 1.248 . . . . 25.0 109.154 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -126.25 156.07 40.88 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.616 1.166 . . . . 25.0 111.157 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.81 134.36 36.99 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.394 1.478 . . . . 25.0 112.68 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -87.77 -29.36 21.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.632 1.573 . . . . 25.0 112.143 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -154.69 165.79 35.45 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 126.099 1.759 . . . . 25.0 109.92 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.28 149.18 38.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.728 0.811 . . . . 25.0 110.654 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -149.58 135.92 19.1 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.543 1.137 . . . . 25.0 109.308 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -113.12 137.45 51.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.411 -1.7 . . . . 25.0 106.411 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.89 127.66 33.33 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.039 0.936 . . . . 25.0 111.019 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.0 mtp-105 -88.42 -22.93 23.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.334 1.453 . . . . 25.0 111.728 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.2 p -133.1 170.13 15.84 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 25.0 109.814 179.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.6 -18.6 63.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.364 0.666 . . . . 25.0 111.861 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -95.17 -6.55 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.735 1.614 . . . . 25.0 112.096 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -90.66 151.42 21.28 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.809 0.843 . . . . 25.0 110.75 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.3 mt -100.67 134.46 43.59 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.251 1.42 . . . . 25.0 109.222 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.9 m -91.65 142.78 27.24 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.936 -1.505 . . . . 25.0 106.936 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -154.15 168.04 27.84 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 121.654 0.74 . . . . 25.0 111.845 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -125.06 157.81 35.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.175 1.39 . . . . 25.0 108.755 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.18 134.15 44.44 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.355 1.062 . . . . 25.0 110.306 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.26 -8.87 69.72 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-O 118.302 -1.277 . . . . 25.0 113.732 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -69.93 132.22 45.63 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 119.147 1.474 . . . . 25.0 110.388 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -97.9 152.06 19.61 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.025 0.93 . . . . 25.0 110.556 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -140.68 155.4 46.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.736 1.214 . . . . 25.0 112.615 -178.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -106.01 130.19 53.98 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.16 122.3 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 123.368 0.667 . . . . 25.0 109.962 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.8 mt -99.58 -44.35 6.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.001 0.92 . . . . 25.0 110.06 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.45 128.46 7.39 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.702 0.801 . . . . 25.0 110.824 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.7 m -125.7 12.54 7.97 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.057 1.343 . . . . 25.0 113.549 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.2 p -93.38 -2.69 54.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.101 0.961 . . . . 25.0 113.525 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -87.82 15.69 6.75 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.385 1.474 . . . . 25.0 113.415 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.94 18.63 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 118.526 0.603 . . . . 25.0 111.964 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -67.26 -9.6 42.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.902 1.281 . . . . 25.0 111.411 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -100.01 107.54 19.5 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 105.948 -1.871 . . . . 25.0 105.948 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m0 -105.13 151.78 23.61 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -98.67 128.03 44.8 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.225 -1.769 . . . . 25.0 106.225 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.6 m -141.62 168.81 14.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.574 0.75 . . . . 25.0 111.085 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.3 ttt-85 -117.73 123.77 46.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.875 -1.528 . . . . 25.0 106.875 177.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.5 t -75.62 116.39 16.29 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 105.941 -1.874 . . . . 25.0 105.941 178.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -77.66 -16.88 58.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.825 0.85 . . . . 25.0 111.536 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -87.87 -46.69 9.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 25.0 111.826 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.8 p -93.5 -20.71 20.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.45 0.907 . . . . 25.0 113.45 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.26 4.38 90.48 Favored Glycine 0 CA--C 1.538 1.489 0 CA-C-O 118.471 -1.183 . . . . 25.0 112.254 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.89 167.15 13.05 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 119.016 1.408 . . . . 25.0 111.688 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.4 p -121.76 145.12 48.36 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.297 1.439 . . . . 25.0 109.125 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.68 -168.31 38.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.85 0.738 . . . . 25.0 112.633 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -120.16 141.41 49.89 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.874 1.27 . . . . 25.0 111.032 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 pt -146.41 152.86 47.02 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.914 1.285 . . . . 25.0 110.087 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.51 123.47 10.54 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.435 2.756 . . . . 25.0 111.303 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.1 p -58.24 -35.7 36.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 CA-C-O 115.921 -1.99 . . . . 25.0 116.235 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.37 -18.43 63.09 Favored 'Trans proline' 0 C--N 1.361 1.208 0 CA-C-N 123.184 2.173 . . . . 25.0 114.432 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.15 -3.6 46.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.003 0.82 . . . . 25.0 110.702 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.6 mt -118.83 158.43 25.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.813 1.645 . . . . 25.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.29 138.13 26.3 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 127.036 2.134 . . . . 25.0 108.295 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.71 141.24 53.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.731 2.287 . . . . 25.0 111.913 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.4 t . . . . . 0 CA--C 1.534 0.365 0 N-CA-C 107.288 -1.375 . . . . 25.0 107.288 178.459 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 108.824 -0.806 . . . . 25.0 108.824 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -130.38 148.99 52.26 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.734 1.214 . . . . 25.0 109.924 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.12 155.53 35.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.156 1.382 . . . . 25.0 110.127 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.88 130.78 35.22 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.872 1.269 . . . . 25.0 112.697 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.2 mt -89.34 -30.12 18.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 25.0 111.293 178.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -148.45 157.11 43.26 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 125.39 1.476 . . . . 25.0 110.152 -178.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -61.04 149.27 37.49 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.27 0.628 . . . . 25.0 110.288 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -144.3 137.31 27.11 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.72 1.208 . . . . 25.0 110.149 178.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -114.56 135.31 54.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.995 -1.484 . . . . 25.0 106.995 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.82 128.96 39.1 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.324 1.05 . . . . 25.0 111.314 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -83.87 -29.01 27.56 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.419 1.488 . . . . 25.0 112.038 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 p -132.12 171.66 13.36 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.205 1.402 . . . . 25.0 110.542 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.75 -17.21 64.01 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.019 0.927 . . . . 25.0 111.833 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -95.08 -5.13 45.0 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.149 1.78 . . . . 25.0 112.301 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -97.31 156.56 16.39 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.272 1.029 . . . . 25.0 111.479 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.3 mt -104.44 136.76 43.41 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.562 1.545 . . . . 25.0 110.659 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.6 m -95.02 145.47 24.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -154.67 169.53 23.67 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.822 0.82 . . . . 25.0 111.636 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -125.43 158.43 34.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.392 1.477 . . . . 25.0 108.932 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -54.3 134.21 45.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.763 1.225 . . . . 25.0 110.0 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.59 -11.52 68.37 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 125.06 1.314 . . . . 25.0 113.552 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.83 134.16 47.11 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 119.194 1.497 . . . . 25.0 110.032 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -100.95 154.02 19.03 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.562 0.745 . . . . 25.0 111.243 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -140.39 154.93 46.88 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.956 1.302 . . . . 25.0 113.737 -177.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -107.11 129.23 54.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 104.049 -2.575 . . . . 25.0 104.049 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.7 mm -81.36 121.11 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 123.197 0.599 . . . . 25.0 109.913 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -93.04 -42.5 9.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.229 1.012 . . . . 25.0 109.205 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.06 126.87 6.22 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.985 0.914 . . . . 25.0 109.913 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.4 p -125.74 12.4 7.93 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.797 1.406 . . . . 25.0 114.797 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.0 p -96.47 -2.16 45.88 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.246 1.419 . . . . 25.0 114.391 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.53 16.31 6.75 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.13 1.372 . . . . 25.0 113.952 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.95 18.63 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 118.75 0.705 . . . . 25.0 112.831 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -67.86 -0.21 4.02 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.734 1.614 . . . . 25.0 112.071 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.6 t-105 -115.92 112.21 21.55 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.834 2.053 . . . . 25.0 106.166 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -110.11 154.12 23.74 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.013 0.925 . . . . 25.0 113.069 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -98.43 127.43 44.36 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 105.426 -2.065 . . . . 25.0 105.426 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.8 m -141.09 168.78 15.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.715 0.769 . . . . 25.0 111.694 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -121.42 123.2 41.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.565 1.546 . . . . 25.0 107.913 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.4 t -74.42 118.34 17.27 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.174 -2.158 . . . . 25.0 105.174 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.45 -12.45 60.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.521 0.728 . . . . 25.0 112.086 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.0 m -88.62 -43.83 11.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.897 1.279 . . . . 25.0 111.567 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 p -98.93 -21.05 16.46 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.987 1.106 . . . . 25.0 113.987 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.14 3.4 89.6 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 118.454 -1.192 . . . . 25.0 112.441 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -85.71 161.48 19.18 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.051 1.425 . . . . 25.0 111.354 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.0 p -120.6 145.32 47.5 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.873 1.269 . . . . 25.0 110.623 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.53 -168.25 38.67 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 124.541 1.067 . . . . 25.0 112.383 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.98 149.24 35.61 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.208 1.403 . . . . 25.0 111.746 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.0 pt -150.04 157.69 37.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.253 1.421 . . . . 25.0 111.003 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -71.26 122.13 8.42 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.978 2.452 . . . . 25.0 108.593 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.4 p -58.39 -35.19 30.59 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 116.953 2.205 . . . . 25.0 116.953 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -63.85 -16.21 53.51 Favored 'Trans proline' 0 C--N 1.36 1.184 0 C-N-CA 122.755 2.303 . . . . 25.0 115.199 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -77.83 -5.21 50.1 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.332 0.969 . . . . 25.0 111.817 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 33.0 mt -119.33 158.46 26.05 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.515 1.126 . . . . 25.0 112.274 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.25 143.26 32.84 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 127.596 2.358 . . . . 25.0 108.428 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -62.44 146.59 95.6 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.809 2.34 . . . . 25.0 111.272 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t . . . . . 0 CA--C 1.532 0.264 0 C-N-CA 123.971 0.909 . . . . 25.0 109.919 -178.891 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 71.9 m . . . . . 0 N--CA 1.475 0.784 0 CA-C-O 119.322 -0.371 . . . . 25.0 110.051 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 t -149.49 157.66 43.48 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 125.331 1.453 . . . . 25.0 110.521 -179.755 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 84.8 mt -79.58 160.83 26.27 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 108.592 -0.892 . . . . 25.0 108.592 178.116 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.3 m-85 -130.16 147.97 51.95 Favored 'General case' 0 CA--C 1.532 0.271 0 C-N-CA 124.247 1.019 . . . . 25.0 109.366 -179.791 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.9 pt-20 -121.5 152.65 38.93 Favored 'General case' 0 CA--C 1.534 0.344 0 C-N-CA 125.092 1.357 . . . . 25.0 110.705 -179.509 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.89 135.57 35.4 Favored 'General case' 0 CA--C 1.531 0.234 0 C-N-CA 125.201 1.4 . . . . 25.0 113.366 -178.658 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 86.1 mt -98.47 -24.56 15.1 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 126.064 1.745 . . . . 25.0 112.242 179.032 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 1.4 m-85 -148.03 153.04 38.43 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.557 1.143 . . . . 25.0 110.527 -179.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.2 m-20 -61.1 149.22 37.84 Favored 'General case' 0 CA--C 1.539 0.538 0 N-CA-C 109.332 -0.618 . . . . 25.0 109.332 175.686 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.5 t80 -146.61 137.23 23.93 Favored 'General case' 0 C--N 1.339 0.112 0 C-N-CA 123.719 0.807 . . . . 25.0 109.592 178.669 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -112.89 136.87 52.06 Favored 'General case' 0 N--CA 1.455 -0.222 0 N-CA-C 106.972 -1.492 . . . . 25.0 106.972 178.097 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.39 127.92 34.16 Favored 'General case' 0 C--N 1.341 0.206 0 C-N-CA 124.261 1.025 . . . . 25.0 110.068 -179.512 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 18.8 mtp180 -93.59 -20.42 20.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.422 1.089 . . . . 25.0 112.338 -178.468 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 31.0 p -130.07 171.27 13.0 Favored 'General case' 0 CA--C 1.536 0.435 0 C-N-CA 125.027 1.331 . . . . 25.0 110.119 179.142 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -68.06 -18.97 64.83 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 124.248 1.019 . . . . 25.0 112.366 178.566 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -101.96 -2.93 28.67 Favored 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 125.771 1.628 . . . . 25.0 112.815 -179.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.0 156.06 18.24 Favored 'General case' 0 C--N 1.345 0.397 0 CA-C-N 119.28 0.945 . . . . 25.0 110.87 -179.283 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 67.3 mt -107.22 140.47 40.04 Favored 'General case' 0 C--N 1.342 0.242 0 C-N-CA 125.314 1.446 . . . . 25.0 110.787 179.628 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 64.5 m -97.5 145.07 26.58 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.674 1.19 . . . . 25.0 107.834 177.67 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 48.1 p90 -156.82 170.81 21.62 Favored 'General case' 0 C--N 1.341 0.214 0 CA-C-O 121.714 0.769 . . . . 25.0 111.074 179.506 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.4 m-70 -122.87 156.81 33.85 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 125.337 1.455 . . . . 25.0 108.727 178.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.21 44.73 Favored 'General case' 0 CA--C 1.537 0.445 0 C-N-CA 124.702 1.201 . . . . 25.0 110.198 -179.865 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 96.45 -9.54 66.93 Favored Glycine 0 CA--C 1.537 1.408 0 C-N-CA 125.343 1.449 . . . . 25.0 113.38 -179.46 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.7 tt0 -71.34 133.97 46.38 Favored 'General case' 0 C--N 1.346 0.441 0 CA-C-N 119.066 1.433 . . . . 25.0 110.19 179.617 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -102.05 152.62 20.76 Favored 'General case' 0 C--N 1.342 0.255 0 C-N-CA 123.69 0.796 . . . . 25.0 110.616 -179.814 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -137.3 156.23 48.5 Favored 'General case' 0 N--CA 1.452 -0.347 0 C-N-CA 125.292 1.437 . . . . 25.0 112.822 -178.303 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 16.7 tt0 -107.45 128.98 54.97 Favored 'General case' 0 N--CA 1.45 -0.467 0 N-CA-C 104.648 -2.353 . . . . 25.0 104.648 177.208 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 32.5 mm -82.07 123.0 37.71 Favored 'Isoleucine or valine' 0 N--CA 1.455 -0.22 0 C-N-CA 123.511 0.725 . . . . 25.0 110.995 -177.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.0 mt -91.45 -44.48 9.09 Favored 'General case' 0 CA--C 1.535 0.391 0 N-CA-C 108.171 -1.048 . . . . 25.0 108.171 178.187 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -158.83 127.46 5.32 Favored 'General case' 0 CA--C 1.538 0.485 0 C-N-CA 124.408 1.083 . . . . 25.0 108.948 178.314 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 69.2 p -125.62 12.5 8.01 Favored 'General case' 0 N--CA 1.47 0.565 0 N-CA-C 115.647 1.721 . . . . 25.0 115.647 -178.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.6 p -93.28 5.32 51.96 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.524 1.13 . . . . 25.0 112.773 179.58 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -91.15 12.43 20.05 Favored 'General case' 0 C--N 1.345 0.377 0 C-N-CA 125.846 1.658 . . . . 25.0 114.711 -178.913 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.66 -157.81 18.7 Favored Glycine 0 CA--C 1.528 0.864 0 CA-C-N 118.651 0.66 . . . . 25.0 111.529 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.4 m-20 -69.47 -1.12 7.7 Favored 'General case' 0 CA--C 1.548 0.882 0 C-N-CA 124.883 1.273 . . . . 25.0 111.717 178.357 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 47.8 t-105 -112.15 105.74 14.17 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 126.52 1.928 . . . . 25.0 106.456 178.936 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -105.38 151.08 24.64 Favored 'General case' 0 C--N 1.345 0.385 0 N-CA-C 113.868 1.062 . . . . 25.0 113.868 -178.453 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -96.02 126.37 41.21 Favored 'General case' 0 N--CA 1.452 -0.352 0 N-CA-C 105.472 -2.048 . . . . 25.0 105.472 177.818 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 24.1 m -142.86 168.28 13.61 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.274 0 CA-C-O 121.933 0.873 . . . . 25.0 112.605 -178.701 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -121.35 127.62 51.45 Favored 'General case' 0 N--CA 1.448 -0.544 0 C-N-CA 126.522 1.929 . . . . 25.0 107.738 176.69 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 47.7 t -76.54 119.66 20.68 Favored 'General case' 0 N--CA 1.447 -0.615 0 N-CA-C 106.788 -1.56 . . . . 25.0 106.788 178.771 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 96.4 mt -76.74 -15.9 59.64 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.334 0.654 . . . . 25.0 111.207 179.125 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.6 m -87.59 -46.08 9.86 Favored 'General case' 0 CA--C 1.537 0.471 0 C-N-CA 125.146 1.378 . . . . 25.0 112.265 -179.643 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.9 p -101.19 -21.05 15.03 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 114.472 1.286 . . . . 25.0 114.472 -177.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.76 2.34 90.5 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.558 -1.134 . . . . 25.0 112.451 -178.571 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.0 mm-40 -84.59 160.94 20.34 Favored 'General case' 0 C--N 1.347 0.47 0 CA-C-N 119.005 1.403 . . . . 25.0 110.871 -179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 37.0 p -121.07 144.28 48.63 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 124.461 1.104 . . . . 25.0 111.202 -179.709 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.47 -168.46 39.03 Favored Glycine 0 CA--C 1.529 0.908 0 C-N-CA 124.478 1.037 . . . . 25.0 112.559 179.433 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 63.2 m-85 -115.17 143.21 45.58 Favored 'General case' 0 C--N 1.34 0.153 0 C-N-CA 125.183 1.393 . . . . 25.0 111.006 179.482 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 49.3 pt -145.22 154.79 54.35 Favored Pre-proline 0 CA--C 1.539 0.555 0 C-N-CA 125.278 1.431 . . . . 25.0 109.82 179.867 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_endo -69.43 122.63 9.39 Favored 'Trans proline' 0 N--CA 1.455 -0.736 0 C-N-CA 122.911 2.407 . . . . 25.0 111.361 179.685 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.0 t -58.86 -36.99 48.69 Favored Pre-proline 0 CA--C 1.549 0.927 0 CA-C-O 116.154 -1.879 . . . . 25.0 115.042 177.894 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -63.63 -17.74 61.25 Favored 'Trans proline' 0 C--N 1.361 1.224 0 C-N-CA 122.539 2.159 . . . . 25.0 114.684 179.544 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.64 -3.92 46.37 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 119.088 0.858 . . . . 25.0 110.343 178.351 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.5 mt -118.84 158.44 25.65 Favored 'General case' 0 C--N 1.345 0.4 0 C-N-CA 125.491 1.516 . . . . 25.0 112.371 -178.926 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.78 141.88 36.76 Favored Pre-proline 0 CA--C 1.537 0.47 0 C-N-CA 127.13 2.172 . . . . 25.0 108.837 178.421 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.8 Cg_endo -66.9 141.64 59.5 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.697 2.265 . . . . 25.0 111.113 -179.65 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 87.6 t -72.75 136.01 26.51 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.375 0 C-N-CA 124.675 1.19 . . . . 25.0 108.19 179.154 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 . . . . . 0 C--O 1.251 1.166 0 C-N-CA 128.135 2.574 . . . . 25.0 109.663 179.907 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 64.1 m . . . . . 0 N--CA 1.476 0.849 0 CA-C-O 120.969 0.414 . . . . 25.0 111.756 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 14.8 t -132.75 148.33 52.32 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 125.034 1.334 . . . . 25.0 110.109 179.758 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 58.0 mt -84.33 163.73 19.41 Favored 'General case' 0 CA--C 1.531 0.225 0 C-N-CA 124.519 1.128 . . . . 25.0 109.407 179.262 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.1 m-85 -131.95 157.1 44.93 Favored 'General case' 0 CA--C 1.536 0.421 0 C-N-CA 125.112 1.365 . . . . 25.0 111.506 -179.159 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.2 pt-20 -133.66 152.23 51.84 Favored 'General case' 0 CA--C 1.536 0.442 0 C-N-CA 125.855 1.662 . . . . 25.0 110.142 178.702 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.76 133.1 37.13 Favored 'General case' 0 CA--C 1.532 0.279 0 C-N-CA 125.741 1.616 . . . . 25.0 113.112 -178.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 96.8 mt -94.46 -28.42 15.49 Favored 'General case' 0 CA--C 1.535 0.402 0 C-N-CA 126.419 1.888 . . . . 25.0 112.391 179.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 2.3 m-85 -146.58 155.22 42.32 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 124.757 1.223 . . . . 25.0 110.436 -178.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.4 m-20 -61.19 149.13 38.5 Favored 'General case' 0 CA--C 1.54 0.581 0 N-CA-C 108.842 -0.799 . . . . 25.0 108.842 175.727 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -147.63 138.64 23.5 Favored 'General case' 0 N--CA 1.461 0.083 0 C-N-CA 123.539 0.736 . . . . 25.0 109.996 179.2 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 60.2 mm-40 -116.97 137.67 52.07 Favored 'General case' 0 C--O 1.233 0.223 0 N-CA-C 107.731 -1.211 . . . . 25.0 107.731 178.391 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.3 130.59 46.89 Favored 'General case' 0 C--N 1.341 0.2 0 C-N-CA 124.309 1.044 . . . . 25.0 111.259 -179.309 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 76.4 mtp180 -90.93 -26.19 19.41 Favored 'General case' 0 CA--C 1.534 0.345 0 C-N-CA 124.48 1.112 . . . . 25.0 111.925 -179.513 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 58.0 p -131.14 172.45 12.1 Favored 'General case' 0 CA--C 1.537 0.448 0 C-N-CA 125.317 1.447 . . . . 25.0 110.437 179.969 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.64 -18.79 64.35 Favored 'General case' 0 CA--C 1.541 0.615 0 C-N-CA 124.084 0.953 . . . . 25.0 112.098 178.463 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -94.86 -8.15 38.12 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 125.562 1.545 . . . . 25.0 112.3 -179.826 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.2 m-20 -94.27 156.67 16.41 Favored 'General case' 0 CA--C 1.535 0.392 0 C-N-CA 124.332 1.053 . . . . 25.0 110.259 -179.636 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 57.9 mt -112.11 141.43 45.79 Favored 'General case' 0 C--N 1.342 0.265 0 C-N-CA 124.83 1.252 . . . . 25.0 110.143 179.109 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 85.7 p -99.34 146.21 26.51 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 125.002 1.321 . . . . 25.0 108.126 178.038 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.8 p90 -159.23 175.68 13.13 Favored 'General case' 0 CA--C 1.531 0.245 0 CA-C-O 121.801 0.81 . . . . 25.0 111.059 -179.401 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 97.8 m-70 -126.88 159.61 33.44 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.151 1.38 . . . . 25.0 108.532 178.127 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.19 134.31 44.49 Favored 'General case' 0 CA--C 1.536 0.436 0 C-N-CA 124.609 1.164 . . . . 25.0 110.292 -178.983 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 98.65 -11.27 62.9 Favored Glycine 0 CA--C 1.537 1.411 0 C-N-CA 125.234 1.397 . . . . 25.0 113.489 -179.573 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.3 tt0 -70.4 136.67 49.8 Favored 'General case' 0 C--N 1.347 0.483 0 CA-C-N 119.212 1.506 . . . . 25.0 109.452 179.394 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.8 mttm -101.67 150.05 23.51 Favored 'General case' 0 C--N 1.343 0.302 0 CA-C-O 121.84 0.829 . . . . 25.0 112.049 -178.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -141.47 161.28 38.3 Favored 'General case' 0 CA--C 1.533 0.324 0 C-N-CA 126.809 2.044 . . . . 25.0 111.295 -178.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.6 tt0 -121.51 137.87 54.54 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 127.459 2.303 . . . . 25.0 105.629 177.679 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -86.73 127.66 40.23 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 122.778 0.431 . . . . 25.0 110.603 -178.433 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 81.8 mt -97.47 -41.08 8.36 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.694 1.198 . . . . 25.0 109.85 178.427 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.0 130.85 9.15 Favored 'General case' 0 C--N 1.346 0.422 0 C-N-CA 123.917 0.887 . . . . 25.0 109.962 179.694 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.6 p -125.64 12.37 7.99 Favored 'General case' 0 CA--C 1.537 0.454 0 N-CA-C 115.447 1.647 . . . . 25.0 115.447 -179.179 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 60.4 p -95.11 0.22 54.08 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.866 1.267 . . . . 25.0 113.225 -179.981 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.6 mt-10 -88.84 16.12 7.36 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 125.746 1.618 . . . . 25.0 113.433 -179.974 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.86 -158.18 18.5 Favored Glycine 0 C--N 1.345 1.064 0 CA-C-N 118.497 0.59 . . . . 25.0 112.869 -179.88 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.64 -7.72 35.68 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 125.298 1.439 . . . . 25.0 112.19 179.792 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 6.8 t-105 -111.57 123.08 49.5 Favored 'General case' 0 C--N 1.343 0.322 0 N-CA-C 105.691 -1.966 . . . . 25.0 105.691 177.86 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.29 157.0 21.48 Favored 'General case' 0 N--CA 1.463 0.225 0 N-CA-C 114.221 1.193 . . . . 25.0 114.221 -177.032 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -95.85 131.97 41.61 Favored 'General case' 0 C--O 1.234 0.237 0 C-N-CA 126.58 1.952 . . . . 25.0 106.283 177.681 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 25.9 m -139.19 167.76 19.79 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.285 0 CA-C-O 122.538 1.161 . . . . 25.0 113.922 -178.609 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 43.7 ttt85 -125.65 114.76 19.12 Favored 'General case' 0 N--CA 1.448 -0.568 0 C-N-CA 128.738 2.815 . . . . 25.0 104.919 176.143 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 28.8 t -74.99 121.92 22.71 Favored 'General case' 0 N--CA 1.449 -0.49 0 N-CA-C 108.463 -0.94 . . . . 25.0 108.463 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -76.73 -21.25 55.55 Favored 'General case' 0 CA--C 1.536 0.42 0 C-N-CA 124.135 0.974 . . . . 25.0 111.418 179.324 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.0 m -88.21 -46.01 9.61 Favored 'General case' 0 CA--C 1.537 0.462 0 C-N-CA 124.616 1.166 . . . . 25.0 112.179 -179.225 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 11.1 p -93.89 -21.53 19.18 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 113.477 0.917 . . . . 25.0 113.477 -178.548 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.45 0.62 87.39 Favored Glycine 0 CA--C 1.537 1.451 0 CA-C-O 118.337 -1.257 . . . . 25.0 112.558 -178.791 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 40.9 mm-40 -90.36 166.9 13.03 Favored 'General case' 0 C--N 1.349 0.55 0 CA-C-N 119.037 1.419 . . . . 25.0 111.789 -178.893 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 26.2 p -122.7 145.47 48.36 Favored 'General case' 0 C--N 1.343 0.309 0 C-N-CA 124.878 1.271 . . . . 25.0 110.513 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.67 -168.41 38.84 Favored Glycine 0 CA--C 1.526 0.781 0 C-N-CA 124.579 1.085 . . . . 25.0 112.117 179.641 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -116.27 137.32 52.24 Favored 'General case' 0 CA--C 1.532 0.255 0 C-N-CA 124.974 1.31 . . . . 25.0 110.912 -179.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 37.8 pt -144.92 155.29 55.66 Favored Pre-proline 0 CA--C 1.546 0.795 0 C-N-CA 124.915 1.286 . . . . 25.0 110.651 -179.671 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.9 Cg_endo -69.08 123.96 10.87 Favored 'Trans proline' 0 C--N 1.353 0.792 0 C-N-CA 123.981 3.121 . . . . 25.0 112.941 -179.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 p -59.46 -36.23 38.57 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-O 115.852 -2.023 . . . . 25.0 115.955 178.282 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.4 Cg_endo -64.98 -18.73 63.0 Favored 'Trans proline' 0 C--N 1.362 1.27 0 CA-C-N 123.322 2.222 . . . . 25.0 114.376 179.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.9 m-85 -79.56 -3.77 48.4 Favored 'General case' 0 CA--C 1.541 0.607 0 CA-C-N 118.906 0.775 . . . . 25.0 110.938 178.707 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 23.0 mt -119.54 158.2 26.81 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.087 1.355 . . . . 25.0 112.38 -179.129 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -142.3 141.09 20.19 Favored Pre-proline 0 CA--C 1.535 0.38 0 C-N-CA 127.452 2.301 . . . . 25.0 107.967 177.931 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.23 146.16 89.89 Favored 'Trans proline' 0 CA--C 1.536 0.609 0 C-N-CA 122.581 2.187 . . . . 25.0 112.229 -179.221 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 65.6 t -72.55 136.06 26.42 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.34 0 C-N-CA 125.085 1.354 . . . . 25.0 108.397 179.688 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.6 m-20 . . . . . 0 C--O 1.251 1.148 0 C-N-CA 127.699 2.4 . . . . 25.0 109.577 179.808 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 13.3 t . . . . . 0 N--CA 1.474 0.76 0 CA-C-O 120.925 0.393 . . . . 25.0 111.44 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 11.1 t -133.4 154.7 50.54 Favored 'General case' 0 CA--C 1.533 0.317 0 C-N-CA 125.435 1.494 . . . . 25.0 109.879 179.641 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 96.7 mt -78.43 153.22 31.69 Favored 'General case' 0 CA--C 1.53 0.206 0 C-N-CA 123.98 0.912 . . . . 25.0 110.15 179.366 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -130.34 150.16 51.7 Favored 'General case' 0 CA--C 1.531 0.244 0 C-N-CA 125.907 1.683 . . . . 25.0 107.194 178.591 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.6 pt-20 -127.34 148.07 50.25 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.354 1.062 . . . . 25.0 110.693 -179.765 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.41 132.49 37.36 Favored 'General case' 0 CA--C 1.53 0.188 0 C-N-CA 125.192 1.397 . . . . 25.0 112.212 -179.138 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.9 mt -89.5 -28.74 19.44 Favored 'General case' 0 CA--C 1.536 0.413 0 C-N-CA 126.338 1.855 . . . . 25.0 112.301 179.888 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 20.9 m-85 -151.65 158.71 43.82 Favored 'General case' 0 C--N 1.344 0.356 0 C-N-CA 124.861 1.264 . . . . 25.0 110.618 -179.345 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.1 m-20 -61.19 149.11 38.56 Favored 'General case' 0 CA--C 1.538 0.51 0 C-N-CA 123.3 0.64 . . . . 25.0 109.863 176.103 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.3 t80 -147.06 135.11 21.47 Favored 'General case' 0 C--N 1.338 0.104 0 C-N-CA 123.907 0.883 . . . . 25.0 109.878 178.483 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 49.2 mm-40 -113.57 136.98 52.22 Favored 'General case' 0 C--O 1.234 0.243 0 N-CA-C 107.146 -1.427 . . . . 25.0 107.146 178.018 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.02 128.73 38.28 Favored 'General case' 0 N--CA 1.453 -0.286 0 C-N-CA 124.554 1.141 . . . . 25.0 111.083 -179.221 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 75.6 mtp180 -82.68 -25.83 32.65 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.789 1.236 . . . . 25.0 111.599 -179.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -130.94 168.92 16.53 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 125.385 1.474 . . . . 25.0 109.98 179.107 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.04 -15.83 63.77 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.2 1.0 . . . . 25.0 112.825 178.796 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -101.31 -2.64 30.56 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 125.778 1.631 . . . . 25.0 113.018 -179.442 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -94.84 156.79 16.21 Favored 'General case' 0 CA--C 1.537 0.461 0 C-N-CA 124.562 1.145 . . . . 25.0 110.187 -179.639 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 30.6 mt -97.43 136.24 38.16 Favored 'General case' 0 C--N 1.344 0.339 0 C-N-CA 124.738 1.215 . . . . 25.0 111.493 179.928 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 73.0 m -98.61 144.02 28.37 Favored 'General case' 0 CA--C 1.532 0.282 0 N-CA-C 107.212 -1.403 . . . . 25.0 107.212 177.249 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.8 p90 -158.34 173.12 17.15 Favored 'General case' 0 CA--C 1.53 0.191 0 CA-C-O 121.932 0.872 . . . . 25.0 111.438 179.964 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 96.5 m-70 -126.43 159.17 34.06 Favored 'General case' 0 CA--C 1.533 0.295 0 C-N-CA 125.329 1.452 . . . . 25.0 108.572 178.12 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.5 tttp -54.17 134.26 44.36 Favored 'General case' 0 CA--C 1.536 0.429 0 C-N-CA 124.75 1.22 . . . . 25.0 110.208 -179.71 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 97.33 -10.22 65.2 Favored Glycine 0 CA--C 1.535 1.341 0 C-N-CA 125.148 1.356 . . . . 25.0 113.462 -179.336 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.13 138.07 51.61 Favored 'General case' 0 C--N 1.348 0.532 0 CA-C-N 119.255 1.527 . . . . 25.0 110.057 179.487 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.7 mttm -102.63 150.76 23.11 Favored 'General case' 0 C--N 1.342 0.275 0 C-N-CA 123.409 0.684 . . . . 25.0 111.764 -179.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.0 m-85 -138.05 159.49 41.89 Favored 'General case' 0 N--CA 1.455 -0.201 0 C-N-CA 125.132 1.373 . . . . 25.0 113.682 -177.858 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.9 tt0 -112.75 125.53 54.42 Favored 'General case' 0 N--CA 1.45 -0.466 0 N-CA-C 103.38 -2.822 . . . . 25.0 103.38 176.616 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 26.8 mm -85.43 122.53 38.45 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.195 0 N-CA-C 108.398 -0.964 . . . . 25.0 108.398 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 91.4 mt -90.19 -41.94 11.32 Favored 'General case' 0 CA--C 1.533 0.314 0 C-N-CA 124.051 0.94 . . . . 25.0 110.115 -179.989 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.57 126.74 5.86 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.841 0.857 . . . . 25.0 109.882 178.98 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.6 p -125.69 12.34 7.96 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 114.818 1.414 . . . . 25.0 114.818 -179.614 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 79.0 p -93.52 -0.86 56.15 Favored 'General case' 0 CA--C 1.542 0.647 0 C-N-CA 124.896 1.278 . . . . 25.0 113.364 -179.859 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.5 mt-10 -89.58 14.22 12.1 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.4 1.48 . . . . 25.0 113.761 179.811 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.82 -157.88 18.58 Favored Glycine 0 C--N 1.343 0.921 0 CA-C-N 118.621 0.646 . . . . 25.0 112.796 -179.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -66.35 -6.85 15.69 Favored 'General case' 0 CA--C 1.546 0.793 0 C-N-CA 125.807 1.643 . . . . 25.0 112.417 179.565 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 56.5 t-105 -109.25 113.49 26.37 Favored 'General case' 0 CA--C 1.534 0.35 0 N-CA-C 106.412 -1.699 . . . . 25.0 106.412 178.549 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -107.86 153.97 22.25 Favored 'General case' 0 C--N 1.344 0.342 0 N-CA-C 113.587 0.958 . . . . 25.0 113.587 -178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -98.63 126.77 44.33 Favored 'General case' 0 N--CA 1.451 -0.386 0 C-N-CA 127.268 2.227 . . . . 25.0 105.162 177.521 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 12.1 m -141.35 170.67 13.09 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.355 0 CA-C-O 122.265 1.031 . . . . 25.0 112.978 -178.779 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 49.8 ttt-85 -128.73 125.09 37.21 Favored 'General case' 0 N--CA 1.446 -0.643 0 C-N-CA 127.637 2.375 . . . . 25.0 108.079 176.553 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.1 t -77.7 122.63 25.61 Favored 'General case' 0 N--CA 1.448 -0.543 0 N-CA-C 106.753 -1.573 . . . . 25.0 106.753 178.501 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 84.8 mt -78.56 -16.72 57.11 Favored 'General case' 0 CA--C 1.538 0.514 0 C-N-CA 123.597 0.759 . . . . 25.0 111.694 179.321 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 90.9 m -86.68 -43.23 12.77 Favored 'General case' 0 CA--C 1.538 0.508 0 C-N-CA 124.572 1.149 . . . . 25.0 111.542 -179.816 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 17.7 p -98.05 -21.8 16.6 Favored 'General case' 0 N--CA 1.47 0.555 0 N-CA-C 113.438 0.903 . . . . 25.0 113.438 -178.946 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.02 1.74 87.95 Favored Glycine 0 CA--C 1.539 1.577 0 CA-C-O 118.297 -1.28 . . . . 25.0 112.499 -178.668 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 41.2 mm-40 -88.04 165.12 15.39 Favored 'General case' 0 C--N 1.347 0.472 0 CA-C-N 119.02 1.41 . . . . 25.0 111.729 -178.617 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.7 p -122.22 149.14 44.08 Favored 'General case' 0 CA--C 1.536 0.405 0 C-N-CA 125.026 1.331 . . . . 25.0 111.851 -179.526 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.64 -168.6 39.15 Favored Glycine 0 CA--C 1.531 1.031 0 C-N-CA 125.338 1.447 . . . . 25.0 111.864 178.813 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 70.9 m-85 -116.39 142.72 46.49 Favored 'General case' 0 CA--C 1.531 0.229 0 C-N-CA 124.486 1.114 . . . . 25.0 109.966 179.196 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 32.7 pt -145.43 157.56 52.29 Favored Pre-proline 0 CA--C 1.544 0.737 0 C-N-CA 124.897 1.279 . . . . 25.0 110.659 -179.397 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.1 Cg_endo -69.99 124.37 10.92 Favored 'Trans proline' 0 CA--C 1.538 0.682 0 C-N-CA 123.793 2.995 . . . . 25.0 110.367 178.335 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.0 p -57.51 -35.93 40.21 Favored Pre-proline 0 CA--C 1.55 0.948 0 N-CA-C 117.174 2.287 . . . . 25.0 117.174 179.513 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -64.25 -16.0 52.65 Favored 'Trans proline' 0 C--N 1.359 1.111 0 C-N-CA 122.819 2.346 . . . . 25.0 114.871 -179.973 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.5 m-85 -78.34 -5.41 52.09 Favored 'General case' 0 CA--C 1.54 0.585 0 CA-C-O 118.094 -0.955 . . . . 25.0 112.103 -179.143 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 50.4 mt -119.47 157.98 27.18 Favored 'General case' 0 C--N 1.347 0.473 0 C-N-CA 124.175 0.99 . . . . 25.0 111.433 179.243 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -141.53 138.14 17.12 Favored Pre-proline 0 CA--C 1.537 0.462 0 C-N-CA 126.653 1.981 . . . . 25.0 108.787 178.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.3 Cg_endo -66.75 146.94 80.29 Favored 'Trans proline' 0 C--N 1.349 0.568 0 C-N-CA 122.85 2.367 . . . . 25.0 111.568 -179.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 60.0 t -72.47 136.02 26.52 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.314 0 C-N-CA 124.686 1.194 . . . . 25.0 108.39 179.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.4 m-20 . . . . . 0 C--O 1.253 1.247 0 C-N-CA 125.164 1.386 . . . . 25.0 108.66 -179.426 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.5 m . . . . . 0 N--CA 1.475 0.792 0 CA-C-O 120.854 0.359 . . . . 25.0 110.729 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 13.5 t -153.76 162.63 41.07 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.314 1.446 . . . . 25.0 110.603 -179.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 71.8 mt -74.19 160.19 31.51 Favored 'General case' 0 CA--C 1.534 0.331 0 N-CA-C 108.278 -1.008 . . . . 25.0 108.278 177.866 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.3 m-85 -122.85 145.7 48.21 Favored 'General case' 0 C--N 1.339 0.146 0 C-N-CA 123.675 0.79 . . . . 25.0 109.713 179.798 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 22.0 pt-20 -123.82 151.42 43.4 Favored 'General case' 0 CA--C 1.531 0.221 0 C-N-CA 125.629 1.572 . . . . 25.0 110.195 -179.898 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.01 134.8 36.26 Favored 'General case' 0 N--CA 1.455 -0.18 0 C-N-CA 124.956 1.302 . . . . 25.0 113.236 -178.389 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 78.4 mt -93.54 -26.56 17.09 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.284 1.434 . . . . 25.0 111.599 178.357 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 4.6 m-85 -147.71 156.35 42.67 Favored 'General case' 0 C--N 1.345 0.385 0 C-N-CA 124.978 1.311 . . . . 25.0 110.344 -178.794 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.08 149.16 37.94 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 123.083 0.553 . . . . 25.0 109.782 176.2 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 86.8 t80 -148.16 137.9 22.38 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.226 1.01 . . . . 25.0 109.946 179.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 44.9 mm-40 -114.34 138.8 50.07 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 107.152 -1.425 . . . . 25.0 107.152 177.961 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.98 128.36 36.47 Favored 'General case' 0 C--N 1.341 0.215 0 C-N-CA 124.49 1.116 . . . . 25.0 111.076 -179.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 23.5 mtp180 -85.94 -25.16 26.24 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 124.932 1.293 . . . . 25.0 112.087 -179.444 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 43.9 p -130.48 170.83 13.71 Favored 'General case' 0 CA--C 1.536 0.419 0 C-N-CA 125.018 1.327 . . . . 25.0 110.211 179.151 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -68.1 -17.31 64.34 Favored 'General case' 0 CA--C 1.542 0.659 0 C-N-CA 124.151 0.98 . . . . 25.0 112.487 178.65 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.18 -3.12 27.91 Favored 'General case' 0 CA--C 1.54 0.581 0 C-N-CA 125.645 1.578 . . . . 25.0 112.635 -179.734 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -91.7 156.77 17.34 Favored 'General case' 0 C--N 1.345 0.378 0 C-N-CA 124.258 1.023 . . . . 25.0 110.157 -179.83 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 80.7 mt -104.55 137.67 42.05 Favored 'General case' 0 CA--C 1.531 0.219 0 C-N-CA 125.099 1.36 . . . . 25.0 111.442 -179.56 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.7 m -96.73 145.75 25.51 Favored 'General case' 0 CA--C 1.532 0.261 0 C-N-CA 125.158 1.383 . . . . 25.0 107.87 177.796 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.4 p90 -158.6 171.11 20.72 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 122.048 0.928 . . . . 25.0 111.859 179.878 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 81.5 m-70 -123.09 159.71 27.92 Favored 'General case' 0 N--CA 1.452 -0.349 0 C-N-CA 126.048 1.739 . . . . 25.0 108.053 177.818 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.23 134.06 44.68 Favored 'General case' 0 CA--C 1.538 0.502 0 C-N-CA 124.25 1.02 . . . . 25.0 109.829 -179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.6 -9.31 68.92 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.06 -1.411 . . . . 25.0 114.129 -179.644 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 22.7 tt0 -69.74 135.82 50.22 Favored 'General case' 0 C--N 1.347 0.479 0 CA-C-N 119.544 1.672 . . . . 25.0 110.108 179.849 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -99.78 151.07 21.67 Favored 'General case' 0 C--N 1.344 0.328 0 C-N-CA 123.579 0.752 . . . . 25.0 112.255 -178.78 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.6 m-85 -141.83 157.28 45.2 Favored 'General case' 0 N--CA 1.452 -0.352 0 C-N-CA 126.495 1.918 . . . . 25.0 111.675 -179.415 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 21.2 tt0 -116.14 134.6 54.76 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 126.695 1.998 . . . . 25.0 106.302 178.002 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.5 mm -82.47 126.64 40.02 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.269 0 C-N-CA 123.645 0.778 . . . . 25.0 111.484 -177.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.2 mt -98.95 -42.85 6.94 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.585 1.154 . . . . 25.0 108.873 177.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.68 125.69 5.4 Favored 'General case' 0 C--N 1.347 0.488 0 C-N-CA 124.524 1.13 . . . . 25.0 109.177 178.652 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.3 p -125.68 12.47 7.97 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 115.317 1.599 . . . . 25.0 115.317 -179.115 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.9 p -92.61 1.19 57.4 Favored 'General case' 0 CA--C 1.543 0.677 0 C-N-CA 124.863 1.265 . . . . 25.0 113.42 -179.816 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.4 mt-10 -90.22 16.13 9.15 Favored 'General case' 0 CA--C 1.538 0.507 0 C-N-CA 125.618 1.567 . . . . 25.0 113.595 -179.658 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.81 -157.9 18.58 Favored Glycine 0 C--N 1.343 0.953 0 CA-C-N 118.705 0.684 . . . . 25.0 111.946 -179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.43 -5.43 19.17 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 125.069 1.348 . . . . 25.0 111.627 178.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 32.8 t-105 -106.1 110.13 22.29 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 126.236 1.815 . . . . 25.0 106.358 178.799 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -107.68 149.49 28.06 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 113.362 0.875 . . . . 25.0 113.362 -178.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 32.4 tt0 -95.41 128.05 41.95 Favored 'General case' 0 N--CA 1.453 -0.285 0 C-N-CA 126.703 2.001 . . . . 25.0 105.719 177.682 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 19.2 m -141.74 170.5 12.72 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 CA-C-O 122.23 1.014 . . . . 25.0 112.927 -178.628 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 37.0 ttt85 -123.66 125.86 45.54 Favored 'General case' 0 N--CA 1.447 -0.576 0 C-N-CA 127.346 2.258 . . . . 25.0 106.38 176.545 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 35.6 t -76.71 119.66 20.81 Favored 'General case' 0 N--CA 1.45 -0.457 0 N-CA-C 107.492 -1.299 . . . . 25.0 107.492 179.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 85.4 mt -74.87 -18.72 60.38 Favored 'General case' 0 CA--C 1.537 0.479 0 C-N-CA 123.541 0.736 . . . . 25.0 111.641 179.337 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 22.7 m -91.03 -44.5 9.27 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 124.395 1.078 . . . . 25.0 112.738 -179.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.2 p -99.05 -21.39 16.23 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 114.29 1.219 . . . . 25.0 114.29 -178.056 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.55 1.2 90.05 Favored Glycine 0 CA--C 1.538 1.478 0 CA-C-O 118.352 -1.249 . . . . 25.0 112.576 -178.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 38.7 mm-40 -84.41 160.69 20.56 Favored 'General case' 0 C--N 1.348 0.501 0 CA-C-N 119.081 1.441 . . . . 25.0 110.943 -179.19 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 30.7 p -120.2 144.31 47.79 Favored 'General case' 0 C--N 1.343 0.284 0 C-N-CA 124.315 1.046 . . . . 25.0 110.805 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.57 -168.34 38.79 Favored Glycine 0 CA--C 1.529 0.909 0 CA-C-N 115.169 -0.923 . . . . 25.0 112.519 179.502 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 62.8 m-85 -114.93 141.58 47.76 Favored 'General case' 0 C--O 1.231 0.111 0 C-N-CA 125.159 1.384 . . . . 25.0 110.759 179.447 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.8 pt -144.17 150.56 49.16 Favored Pre-proline 0 CA--C 1.542 0.637 0 C-N-CA 125.27 1.428 . . . . 25.0 109.536 179.708 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -69.68 122.89 9.58 Favored 'Trans proline' 0 N--CA 1.457 -0.638 0 C-N-CA 123.546 2.83 . . . . 25.0 111.647 -179.845 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 43.8 p -59.35 -36.17 38.46 Favored Pre-proline 0 CA--C 1.548 0.893 0 CA-C-O 116.049 -1.929 . . . . 25.0 115.813 178.161 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_endo -64.62 -18.59 63.23 Favored 'Trans proline' 0 C--N 1.362 1.248 0 CA-C-N 123.101 2.143 . . . . 25.0 114.624 179.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.1 m-85 -79.32 -4.08 49.15 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 123.759 0.823 . . . . 25.0 111.0 179.091 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.5 mt -118.73 158.45 25.53 Favored 'General case' 0 C--N 1.345 0.372 0 C-N-CA 125.25 1.42 . . . . 25.0 112.907 -177.95 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.79 144.79 43.17 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.572 2.349 . . . . 25.0 108.125 178.122 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -64.25 147.15 91.11 Favored 'Trans proline' 0 CA--C 1.536 0.614 0 C-N-CA 122.829 2.353 . . . . 25.0 111.573 -179.84 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 54.5 t -72.57 136.0 26.55 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.303 0 C-N-CA 124.899 1.28 . . . . 25.0 108.798 179.862 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.5 m-20 . . . . . 0 C--O 1.25 1.115 0 C-N-CA 127.398 2.279 . . . . 25.0 109.805 179.831 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.472 0.626 0 CA-C-O 119.211 -0.424 . . . . 25.0 109.958 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.0 t -144.56 152.26 40.29 Favored 'General case' 0 CA--C 1.534 0.35 0 C-N-CA 125.148 1.379 . . . . 25.0 110.187 179.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 62.0 mt -83.63 163.32 20.4 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 124.372 1.069 . . . . 25.0 110.101 179.539 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 31.5 m-85 -131.14 151.39 51.5 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 125.195 1.398 . . . . 25.0 109.716 179.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.8 pt-20 -126.2 153.03 45.23 Favored 'General case' 0 CA--C 1.534 0.346 0 C-N-CA 124.938 1.295 . . . . 25.0 110.363 179.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.81 131.14 35.37 Favored 'General case' 0 CA--C 1.531 0.247 0 C-N-CA 125.362 1.465 . . . . 25.0 112.505 -178.95 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.8 mt -89.43 -30.41 18.34 Favored 'General case' 0 CA--C 1.535 0.367 0 C-N-CA 125.684 1.594 . . . . 25.0 111.523 179.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 77.0 m-85 -153.06 163.9 38.99 Favored 'General case' 0 CA--C 1.533 0.302 0 C-N-CA 126.232 1.813 . . . . 25.0 109.681 -179.776 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.12 149.14 38.2 Favored 'General case' 0 CA--C 1.538 0.497 0 C-N-CA 123.948 0.899 . . . . 25.0 111.458 177.304 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 85.0 t80 -145.19 137.09 25.6 Favored 'General case' 0 C--N 1.34 0.179 0 C-N-CA 125.128 1.371 . . . . 25.0 109.628 178.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 39.3 mm-40 -113.01 134.88 54.31 Favored 'General case' 0 C--O 1.233 0.222 0 N-CA-C 107.696 -1.224 . . . . 25.0 107.696 178.423 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.97 129.12 39.81 Favored 'General case' 0 C--N 1.341 0.221 0 C-N-CA 124.446 1.098 . . . . 25.0 109.964 179.943 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 77.6 mtp180 -93.76 -21.46 19.3 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.023 0.929 . . . . 25.0 112.567 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 44.8 p -129.86 171.1 13.08 Favored 'General case' 0 CA--C 1.536 0.426 0 C-N-CA 124.884 1.274 . . . . 25.0 110.36 179.416 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.19 -18.36 63.91 Favored 'General case' 0 CA--C 1.542 0.649 0 C-N-CA 124.033 0.933 . . . . 25.0 111.918 178.355 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -97.41 -3.64 39.79 Favored 'General case' 0 CA--C 1.537 0.47 0 C-N-CA 125.88 1.672 . . . . 25.0 112.264 -179.799 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 70.9 m-20 -94.87 158.49 15.46 Favored 'General case' 0 C--N 1.344 0.362 0 C-N-CA 124.313 1.045 . . . . 25.0 111.296 -179.01 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 68.5 mt -111.97 140.11 46.9 Favored 'General case' 0 C--N 1.343 0.29 0 C-N-CA 125.297 1.439 . . . . 25.0 109.998 179.095 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 68.4 m -95.85 145.8 25.07 Favored 'General case' 0 C--O 1.234 0.288 0 N-CA-C 107.582 -1.266 . . . . 25.0 107.582 178.014 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -155.24 169.45 24.14 Favored 'General case' 0 C--N 1.341 0.2 0 CA-C-O 122.021 0.915 . . . . 25.0 110.942 179.396 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 78.2 m-70 -123.14 160.4 26.55 Favored 'General case' 0 N--CA 1.45 -0.435 0 C-N-CA 125.432 1.493 . . . . 25.0 108.228 178.545 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.4 tttt -54.31 134.14 45.13 Favored 'General case' 0 CA--C 1.537 0.474 0 C-N-CA 124.76 1.224 . . . . 25.0 109.881 -179.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.84 -11.28 68.12 Favored Glycine 0 CA--C 1.539 1.545 0 C-N-CA 125.115 1.34 . . . . 25.0 113.837 -179.391 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.2 tt0 -71.5 137.75 48.4 Favored 'General case' 0 C--N 1.347 0.487 0 CA-C-N 119.376 1.588 . . . . 25.0 110.064 179.604 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.0 mttm -106.75 153.27 22.69 Favored 'General case' 0 C--N 1.342 0.262 0 CA-C-O 121.781 0.801 . . . . 25.0 112.218 -179.208 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 97.7 m-85 -140.51 157.91 44.79 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 126.654 1.982 . . . . 25.0 112.532 -178.854 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 28.4 tt0 -113.85 136.16 53.17 Favored 'General case' 0 CA--C 1.534 0.328 0 N-CA-C 105.105 -2.183 . . . . 25.0 105.105 177.006 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 46.5 mm -82.25 124.36 39.14 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.256 0 C-N-CA 123.457 0.703 . . . . 25.0 111.199 -178.261 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 47.9 mt -90.92 -44.03 9.62 Favored 'General case' 0 CA--C 1.535 0.374 0 N-CA-C 107.649 -1.241 . . . . 25.0 107.649 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -159.87 129.92 5.47 Favored 'General case' 0 CA--C 1.538 0.491 0 C-N-CA 124.507 1.123 . . . . 25.0 109.09 178.808 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 78.2 p -125.51 12.45 8.07 Favored 'General case' 0 N--CA 1.47 0.545 0 N-CA-C 115.722 1.749 . . . . 25.0 115.722 -178.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 68.6 p -95.18 5.32 52.12 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 124.65 1.18 . . . . 25.0 112.718 179.479 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 36.1 mt-10 -88.51 13.91 10.97 Favored 'General case' 0 CA--C 1.537 0.443 0 C-N-CA 126.23 1.812 . . . . 25.0 113.788 -179.5 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.62 -158.0 18.69 Favored Glycine 0 C--N 1.343 0.934 0 N-CA-C 111.633 -0.587 . . . . 25.0 111.633 -179.267 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.9 m-20 -67.85 -7.18 25.84 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.914 1.286 . . . . 25.0 111.365 178.614 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 61.9 t-105 -107.6 116.14 31.41 Favored 'General case' 0 N--CA 1.452 -0.343 0 C-N-CA 126.984 2.114 . . . . 25.0 106.382 178.819 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.5 m0 -111.7 153.83 25.87 Favored 'General case' 0 N--CA 1.465 0.312 0 N-CA-C 113.473 0.916 . . . . 25.0 113.473 -178.288 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -97.28 130.49 44.46 Favored 'General case' 0 N--CA 1.454 -0.274 0 C-N-CA 126.879 2.072 . . . . 25.0 106.041 177.968 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 21.5 m -140.14 166.74 19.66 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.283 0 CA-C-O 122.256 1.027 . . . . 25.0 113.678 -178.49 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 30.0 ttt85 -125.37 122.82 37.89 Favored 'General case' 0 N--CA 1.448 -0.56 0 C-N-CA 127.309 2.244 . . . . 25.0 105.827 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 34.8 t -76.33 123.14 25.48 Favored 'General case' 0 N--CA 1.448 -0.533 0 N-CA-C 108.803 -0.814 . . . . 25.0 108.803 -179.999 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.17 -19.43 58.46 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 123.847 0.859 . . . . 25.0 110.975 178.618 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 93.3 m -88.32 -45.92 9.62 Favored 'General case' 0 CA--C 1.537 0.473 0 C-N-CA 125.165 1.386 . . . . 25.0 112.491 -179.224 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 12.8 p -97.63 -21.55 16.98 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 113.915 1.08 . . . . 25.0 113.915 -178.206 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.33 1.81 88.69 Favored Glycine 0 CA--C 1.538 1.482 0 CA-C-O 118.419 -1.211 . . . . 25.0 112.608 -178.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 44.2 mm-40 -87.54 167.18 14.17 Favored 'General case' 0 C--N 1.348 0.514 0 CA-C-N 118.974 1.387 . . . . 25.0 111.417 -178.783 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 51.3 p -121.0 145.34 47.87 Favored 'General case' 0 C--N 1.343 0.321 0 C-N-CA 124.771 1.228 . . . . 25.0 111.189 -179.712 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.56 -168.46 38.99 Favored Glycine 0 CA--C 1.529 0.948 0 C-N-CA 124.453 1.025 . . . . 25.0 112.646 179.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -117.19 142.93 46.42 Favored 'General case' 0 CA--C 1.529 0.171 0 C-N-CA 124.914 1.286 . . . . 25.0 110.73 179.822 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 39.4 pt -146.23 150.56 41.84 Favored Pre-proline 0 CA--C 1.542 0.659 0 C-N-CA 124.807 1.243 . . . . 25.0 110.283 179.405 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 53.2 Cg_endo -69.29 123.39 10.21 Favored 'Trans proline' 0 C--N 1.35 0.64 0 C-N-CA 123.89 3.06 . . . . 25.0 111.464 179.652 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 45.5 p -58.97 -35.84 36.47 Favored Pre-proline 0 CA--C 1.551 0.983 0 N-CA-C 116.589 2.07 . . . . 25.0 116.589 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_endo -64.84 -18.53 62.66 Favored 'Trans proline' 0 C--N 1.361 1.207 0 CA-C-N 123.277 2.206 . . . . 25.0 114.797 179.853 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -78.87 -4.18 48.36 Favored 'General case' 0 CA--C 1.544 0.722 0 CA-C-N 119.04 0.836 . . . . 25.0 110.716 179.187 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 22.1 mt -119.82 159.25 24.94 Favored 'General case' 0 C--N 1.343 0.32 0 C-N-CA 125.749 1.62 . . . . 25.0 112.6 -178.717 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -135.8 139.46 30.75 Favored Pre-proline 0 CA--C 1.535 0.393 0 C-N-CA 126.852 2.061 . . . . 25.0 107.98 177.725 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -65.28 142.52 73.48 Favored 'Trans proline' 0 C--N 1.349 0.586 0 C-N-CA 122.541 2.161 . . . . 25.0 110.046 179.915 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 86.1 t -72.57 135.76 27.07 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.313 0 C-N-CA 123.73 0.812 . . . . 25.0 108.945 -179.596 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.9 m-20 . . . . . 0 C--O 1.252 1.2 0 C-N-CA 127.373 2.269 . . . . 25.0 111.748 179.576 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 66.8 m . . . . . 0 N--CA 1.475 0.824 0 CA-C-O 119.174 -0.441 . . . . 25.0 111.952 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 10.4 t -132.44 151.06 52.03 Favored 'General case' 0 CA--C 1.533 0.303 0 C-N-CA 124.812 1.245 . . . . 25.0 111.145 -179.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 87.0 mt -83.64 164.49 19.67 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 124.968 1.307 . . . . 25.0 108.723 178.675 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.8 m-85 -131.29 148.39 52.68 Favored 'General case' 0 CA--C 1.532 0.284 0 C-N-CA 124.33 1.052 . . . . 25.0 109.979 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -125.58 155.54 40.53 Favored 'General case' 0 CA--C 1.535 0.37 0 C-N-CA 125.077 1.351 . . . . 25.0 110.886 179.989 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.01 133.55 37.96 Favored 'General case' 0 CA--C 1.532 0.259 0 C-N-CA 125.329 1.452 . . . . 25.0 113.624 -178.486 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 82.8 mt -90.08 -29.34 18.42 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.265 1.826 . . . . 25.0 112.071 179.207 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 26.4 m-85 -152.04 161.5 42.53 Favored 'General case' 0 C--N 1.343 0.314 0 C-N-CA 125.723 1.609 . . . . 25.0 110.093 -178.969 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.1 m-20 -61.04 149.22 37.63 Favored 'General case' 0 CA--C 1.539 0.552 0 C-N-CA 122.984 0.514 . . . . 25.0 109.795 176.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.4 t80 -145.51 138.58 26.2 Favored 'General case' 0 C--N 1.339 0.135 0 C-N-CA 124.179 0.991 . . . . 25.0 110.308 179.0 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 52.5 mm-40 -117.15 135.28 53.88 Favored 'General case' 0 C--O 1.233 0.215 0 N-CA-C 107.181 -1.414 . . . . 25.0 107.181 177.725 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.46 131.18 49.96 Favored 'General case' 0 N--CA 1.454 -0.237 0 C-N-CA 125.077 1.351 . . . . 25.0 111.65 -179.113 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 28.2 mtp-105 -83.2 -29.36 28.59 Favored 'General case' 0 CA--C 1.533 0.309 0 C-N-CA 124.21 1.004 . . . . 25.0 111.628 -179.77 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 80.3 p -131.61 173.62 10.94 Favored 'General case' 0 CA--C 1.536 0.41 0 C-N-CA 125.202 1.401 . . . . 25.0 111.418 -179.479 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -68.04 -18.65 64.75 Favored 'General case' 0 CA--C 1.542 0.639 0 C-N-CA 125.107 1.363 . . . . 25.0 112.705 178.504 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -97.3 -6.33 34.63 Favored 'General case' 0 CA--C 1.539 0.528 0 C-N-CA 125.463 1.505 . . . . 25.0 112.421 -179.761 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 73.0 m-20 -95.3 155.95 16.52 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 124.876 1.27 . . . . 25.0 109.305 -179.98 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 52.0 mt -109.95 143.41 39.95 Favored 'General case' 0 C--N 1.343 0.295 0 C-N-CA 124.487 1.115 . . . . 25.0 110.796 179.533 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 70.1 m -96.8 147.8 23.56 Favored 'General case' 0 C--O 1.234 0.278 0 C-N-CA 125.11 1.364 . . . . 25.0 108.116 178.264 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.6 p90 -156.07 170.0 23.2 Favored 'General case' 0 CA--C 1.529 0.16 0 CA-C-O 121.755 0.788 . . . . 25.0 111.226 179.674 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 90.1 m-70 -120.7 157.24 30.07 Favored 'General case' 0 N--CA 1.453 -0.28 0 C-N-CA 125.263 1.425 . . . . 25.0 108.488 178.343 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.9 tttt -54.23 134.18 44.69 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 124.845 1.258 . . . . 25.0 110.4 -179.882 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.62 -8.48 68.69 Favored Glycine 0 CA--C 1.538 1.503 0 C-N-CA 125.25 1.405 . . . . 25.0 113.752 -179.772 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.6 tt0 -70.34 133.14 46.65 Favored 'General case' 0 C--N 1.345 0.409 0 CA-C-N 119.168 1.484 . . . . 25.0 110.681 179.939 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -97.79 152.69 18.89 Favored 'General case' 0 C--N 1.343 0.301 0 C-N-CA 123.778 0.831 . . . . 25.0 110.971 -179.821 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.9 m-85 -140.29 154.51 46.84 Favored 'General case' 0 N--CA 1.452 -0.374 0 C-N-CA 125.536 1.534 . . . . 25.0 111.564 -178.614 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 63.3 tt0 -110.14 130.04 55.61 Favored 'General case' 0 N--CA 1.454 -0.228 0 N-CA-C 104.53 -2.396 . . . . 25.0 104.53 177.244 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 25.5 mm -82.9 125.4 40.01 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.25 0 C-N-CA 123.148 0.579 . . . . 25.0 111.009 -177.223 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.1 mt -95.27 -41.85 8.83 Favored 'General case' 0 CA--C 1.534 0.354 0 C-N-CA 124.606 1.162 . . . . 25.0 109.341 178.632 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -158.58 129.09 6.08 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.566 1.146 . . . . 25.0 109.401 179.149 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 79.8 p -125.6 12.38 8.01 Favored 'General case' 0 CA--C 1.537 0.447 0 N-CA-C 115.491 1.664 . . . . 25.0 115.491 -179.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 64.6 p -94.19 2.44 55.93 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 124.684 1.193 . . . . 25.0 113.298 179.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.5 mt-10 -88.57 14.56 9.64 Favored 'General case' 0 CA--C 1.538 0.487 0 C-N-CA 125.689 1.596 . . . . 25.0 114.036 -179.567 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.67 -158.02 18.66 Favored Glycine 0 C--N 1.344 0.989 0 CA-C-N 118.533 0.606 . . . . 25.0 112.706 -179.993 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.4 -2.9 9.5 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 125.641 1.576 . . . . 25.0 112.258 179.406 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 15.4 t-105 -117.43 120.2 37.4 Favored 'General case' 0 CA--C 1.537 0.445 0 N-CA-C 105.573 -2.01 . . . . 25.0 105.573 178.366 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -112.16 157.54 20.73 Favored 'General case' 0 N--CA 1.465 0.291 0 N-CA-C 114.695 1.368 . . . . 25.0 114.695 -177.064 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 38.6 tt0 -96.97 125.24 41.26 Favored 'General case' 0 N--CA 1.453 -0.3 0 C-N-CA 127.353 2.261 . . . . 25.0 105.346 177.403 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 17.2 m -143.43 171.53 8.48 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.335 0 CA-C-O 122.148 0.975 . . . . 25.0 112.786 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 54.6 ttt-85 -122.51 125.74 46.39 Favored 'General case' 0 N--CA 1.448 -0.565 0 C-N-CA 127.393 2.277 . . . . 25.0 108.012 177.055 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 42.3 t -77.87 119.16 20.96 Favored 'General case' 0 N--CA 1.449 -0.481 0 N-CA-C 106.245 -1.761 . . . . 25.0 106.245 178.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 88.6 mt -75.86 -17.44 59.81 Favored 'General case' 0 CA--C 1.538 0.511 0 C-N-CA 123.737 0.815 . . . . 25.0 112.057 179.936 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 82.5 m -84.08 -44.47 14.04 Favored 'General case' 0 CA--C 1.536 0.437 0 C-N-CA 124.747 1.219 . . . . 25.0 112.217 -179.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 24.3 p -100.61 -19.33 16.16 Favored 'General case' 0 N--CA 1.469 0.485 0 N-CA-C 114.023 1.12 . . . . 25.0 114.023 -178.084 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.12 1.86 88.29 Favored Glycine 0 CA--C 1.539 1.536 0 CA-C-O 118.608 -1.107 . . . . 25.0 112.164 -178.436 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.5 mm-40 -83.06 167.15 18.14 Favored 'General case' 0 C--N 1.348 0.511 0 CA-C-N 118.776 1.288 . . . . 25.0 111.153 -178.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 38.3 p -125.05 147.85 48.78 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 124.707 1.203 . . . . 25.0 110.462 179.325 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.82 -168.55 38.97 Favored Glycine 0 CA--C 1.528 0.881 0 C-N-CA 124.49 1.043 . . . . 25.0 112.044 179.66 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.8 m-85 -120.12 140.35 51.21 Favored 'General case' 0 CA--C 1.532 0.263 0 C-N-CA 124.418 1.087 . . . . 25.0 110.338 -179.838 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 41.0 pt -147.24 156.6 46.41 Favored Pre-proline 0 CA--C 1.545 0.757 0 C-N-CA 125.176 1.39 . . . . 25.0 110.793 -179.757 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 48.5 Cg_endo -69.16 123.13 9.98 Favored 'Trans proline' 0 C--N 1.351 0.706 0 C-N-CA 123.903 3.069 . . . . 25.0 112.755 179.555 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 p -59.94 -35.47 28.92 Favored Pre-proline 0 CA--C 1.551 1.016 0 CA-C-O 115.785 -2.055 . . . . 25.0 115.509 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.3 Cg_endo -64.3 -18.98 65.15 Favored 'Trans proline' 0 C--N 1.363 1.312 0 CA-C-N 123.488 2.281 . . . . 25.0 114.245 179.395 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.8 m-85 -79.12 -3.12 43.89 Favored 'General case' 0 CA--C 1.543 0.695 0 CA-C-N 119.064 0.847 . . . . 25.0 110.335 177.995 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 46.2 mt -119.13 158.18 26.43 Favored 'General case' 0 CA--C 1.535 0.382 0 C-N-CA 125.831 1.653 . . . . 25.0 111.494 -179.729 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -138.41 142.74 35.89 Favored Pre-proline 0 CA--C 1.535 0.394 0 C-N-CA 127.133 2.173 . . . . 25.0 108.478 178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -63.61 145.95 92.06 Favored 'Trans proline' 0 C--N 1.348 0.551 0 C-N-CA 122.738 2.292 . . . . 25.0 111.03 -179.544 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 75.9 t -72.42 135.85 26.91 Favored 'Isoleucine or valine' 0 CA--C 1.533 0.309 0 C-N-CA 124.115 0.966 . . . . 25.0 108.468 -179.843 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.251 1.163 0 C-N-CA 127.223 2.209 . . . . 25.0 109.665 -179.906 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 19.7 t . . . . . 0 N--CA 1.474 0.749 0 CA-C-O 120.711 0.291 . . . . 25.0 111.287 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.0 t -126.98 147.77 50.11 Favored 'General case' 0 CA--C 1.533 0.318 0 C-N-CA 125.224 1.41 . . . . 25.0 109.345 179.619 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 69.5 mt -86.9 162.87 17.48 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.214 1.006 . . . . 25.0 111.361 -179.641 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -134.63 148.21 50.34 Favored 'General case' 0 CA--C 1.535 0.375 0 C-N-CA 126.382 1.873 . . . . 25.0 107.671 178.847 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.0 pt-20 -127.46 153.38 46.36 Favored 'General case' 0 C--N 1.343 0.311 0 C-N-CA 123.628 0.771 . . . . 25.0 111.655 -179.609 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -74.57 132.76 42.07 Favored 'General case' 0 CA--C 1.53 0.21 0 C-N-CA 126.051 1.74 . . . . 25.0 112.495 -179.177 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 94.1 mt -91.8 -28.75 17.16 Favored 'General case' 0 CA--C 1.534 0.347 0 C-N-CA 125.976 1.71 . . . . 25.0 111.887 179.509 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 24.3 m-85 -150.86 160.15 44.08 Favored 'General case' 0 C--O 1.235 0.34 0 C-N-CA 125.734 1.614 . . . . 25.0 109.652 -179.478 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 60.8 m-20 -61.04 149.17 37.79 Favored 'General case' 0 CA--C 1.539 0.539 0 N-CA-C 109.717 -0.475 . . . . 25.0 109.717 176.441 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.3 t80 -146.55 135.72 22.66 Favored 'General case' 0 C--N 1.337 0.06 0 C-N-CA 124.179 0.991 . . . . 25.0 108.927 178.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 53.6 mm-40 -114.54 139.32 49.68 Favored 'General case' 0 C--O 1.233 0.193 0 N-CA-C 107.363 -1.347 . . . . 25.0 107.363 178.302 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.6 126.83 29.15 Favored 'General case' 0 N--CA 1.452 -0.33 0 C-N-CA 124.564 1.145 . . . . 25.0 110.558 -179.311 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 33.5 mtp-105 -86.46 -24.26 25.69 Favored 'General case' 0 CA--C 1.533 0.319 0 C-N-CA 124.742 1.217 . . . . 25.0 111.727 -179.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 68.5 p -129.3 170.11 14.03 Favored 'General case' 0 CA--C 1.535 0.381 0 C-N-CA 125.454 1.502 . . . . 25.0 109.977 178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -67.78 -16.83 64.31 Favored 'General case' 0 CA--C 1.542 0.652 0 C-N-CA 124.462 1.105 . . . . 25.0 113.02 179.116 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -102.74 -2.45 28.11 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 125.572 1.549 . . . . 25.0 113.105 -179.405 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.0 m-20 -91.73 157.98 16.62 Favored 'General case' 0 C--N 1.345 0.401 0 C-N-CA 124.08 0.952 . . . . 25.0 110.657 -179.622 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 77.8 mt -102.24 138.05 39.68 Favored 'General case' 0 CA--C 1.533 0.315 0 C-N-CA 125.27 1.428 . . . . 25.0 111.225 -179.675 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 71.2 m -99.43 142.88 30.33 Favored 'General case' 0 CA--C 1.533 0.322 0 C-N-CA 125.154 1.382 . . . . 25.0 107.459 177.425 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.2 p90 -159.93 173.83 15.32 Favored 'General case' 0 C--N 1.341 0.236 0 CA-C-O 121.551 0.691 . . . . 25.0 111.942 -179.724 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 72.6 m-70 -126.01 159.87 31.57 Favored 'General case' 0 CA--C 1.531 0.245 0 C-N-CA 125.333 1.453 . . . . 25.0 110.374 179.102 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -54.19 134.35 44.53 Favored 'General case' 0 CA--C 1.537 0.452 0 C-N-CA 126.321 1.848 . . . . 25.0 110.993 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.12 -11.27 69.46 Favored Glycine 0 CA--C 1.536 1.352 0 C-N-CA 125.348 1.452 . . . . 25.0 114.107 179.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -74.2 137.77 43.31 Favored 'General case' 0 C--N 1.345 0.403 0 CA-C-N 118.88 1.34 . . . . 25.0 109.998 179.668 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.2 mttm -100.2 153.58 19.15 Favored 'General case' 0 C--N 1.344 0.327 0 C-N-CA 123.735 0.814 . . . . 25.0 111.245 -179.466 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 96.1 m-85 -140.01 153.02 46.71 Favored 'General case' 0 N--CA 1.451 -0.376 0 C-N-CA 125.652 1.581 . . . . 25.0 112.238 -178.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 47.3 tt0 -105.35 131.26 53.02 Favored 'General case' 0 N--CA 1.451 -0.39 0 C-N-CA 126.643 1.977 . . . . 25.0 105.75 177.782 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 40.9 mm -84.38 123.17 38.8 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.284 0 N-CA-C 109.101 -0.703 . . . . 25.0 109.101 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 85.7 mt -93.03 -44.62 8.31 Favored 'General case' 0 C--N 1.342 0.261 0 C-N-CA 123.873 0.869 . . . . 25.0 109.737 178.851 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.05 130.04 8.6 Favored 'General case' 0 C--N 1.346 0.418 0 C-N-CA 123.652 0.781 . . . . 25.0 110.074 179.775 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 88.9 p -125.59 12.32 8.01 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 125.158 1.383 . . . . 25.0 114.584 -179.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 58.1 p -93.9 -2.3 53.52 Favored 'General case' 0 CA--C 1.541 0.623 0 C-N-CA 124.896 1.278 . . . . 25.0 113.04 179.912 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 34.8 mt-10 -86.19 15.53 5.12 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.518 1.527 . . . . 25.0 112.922 179.442 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.78 -158.19 18.56 Favored Glycine 0 C--N 1.345 1.067 0 CA-C-O 121.506 0.503 . . . . 25.0 112.362 -179.806 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 78.5 m-20 -66.16 -12.14 53.93 Favored 'General case' 0 CA--C 1.544 0.746 0 C-N-CA 125.488 1.515 . . . . 25.0 111.719 179.705 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 22.7 t-105 -101.57 114.61 28.79 Favored 'General case' 0 CA--C 1.533 0.296 0 C-N-CA 126.374 1.869 . . . . 25.0 106.25 179.058 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.4 m0 -105.75 150.64 25.33 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 113.403 0.89 . . . . 25.0 113.403 -178.324 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -96.87 129.38 44.32 Favored 'General case' 0 N--CA 1.453 -0.289 0 C-N-CA 126.541 1.936 . . . . 25.0 105.936 177.627 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 13.1 m -140.41 168.96 16.38 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.251 0 CA-C-O 121.962 0.887 . . . . 25.0 112.671 -179.041 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 56.4 ttt-85 -125.88 128.67 47.96 Favored 'General case' 0 N--CA 1.449 -0.479 0 C-N-CA 127.033 2.133 . . . . 25.0 106.922 176.47 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 36.8 t -78.66 125.03 28.81 Favored 'General case' 0 N--CA 1.448 -0.556 0 N-CA-C 108.371 -0.974 . . . . 25.0 108.371 179.438 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 60.0 mt -73.03 -17.15 61.47 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.352 0.661 . . . . 25.0 111.012 178.379 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 86.3 m -90.95 -46.21 8.3 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.09 1.356 . . . . 25.0 112.971 -179.28 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 15.5 p -100.4 -21.97 15.21 Favored 'General case' 0 N--CA 1.471 0.579 0 N-CA-C 114.514 1.301 . . . . 25.0 114.514 -177.54 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 79.35 1.39 85.98 Favored Glycine 0 CA--C 1.537 1.455 0 CA-C-O 118.713 -1.048 . . . . 25.0 112.364 -178.678 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 37.5 mm-40 -81.32 157.93 24.91 Favored 'General case' 0 C--N 1.347 0.475 0 CA-C-N 118.726 1.263 . . . . 25.0 110.727 -179.15 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 47.8 p -119.65 144.89 46.92 Favored 'General case' 0 CA--C 1.531 0.246 0 C-N-CA 124.129 0.972 . . . . 25.0 110.286 179.845 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.6 -168.37 38.82 Favored Glycine 0 CA--C 1.527 0.791 0 C-N-CA 125.212 1.387 . . . . 25.0 111.091 -179.898 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 67.8 m-85 -115.16 140.28 49.21 Favored 'General case' 0 C--O 1.232 0.169 0 C-N-CA 123.857 0.863 . . . . 25.0 110.706 -179.566 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 29.7 pt -141.01 153.22 66.97 Favored Pre-proline 0 CA--C 1.541 0.605 0 C-N-CA 125.107 1.363 . . . . 25.0 109.743 179.915 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 49.5 Cg_endo -69.35 122.89 9.69 Favored 'Trans proline' 0 N--CA 1.458 -0.582 0 C-N-CA 123.359 2.706 . . . . 25.0 112.007 179.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.7 p -59.74 -36.6 41.17 Favored Pre-proline 0 CA--C 1.551 0.988 0 CA-C-O 116.11 -1.9 . . . . 25.0 115.205 177.631 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 54.3 Cg_endo -65.08 -18.56 62.05 Favored 'Trans proline' 0 C--N 1.362 1.248 0 C-N-CA 122.627 2.218 . . . . 25.0 114.659 179.334 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 9.7 m-85 -78.6 -2.31 38.32 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 124.205 1.002 . . . . 25.0 110.784 178.953 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 27.1 mt -118.19 158.48 25.03 Favored 'General case' 0 C--N 1.345 0.379 0 C-N-CA 125.035 1.334 . . . . 25.0 112.753 -178.482 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -137.43 138.02 23.72 Favored Pre-proline 0 CA--C 1.537 0.459 0 C-N-CA 126.822 2.049 . . . . 25.0 108.304 178.161 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 52.1 Cg_endo -66.68 138.36 49.07 Favored 'Trans proline' 0 C--N 1.348 0.535 0 C-N-CA 122.955 2.436 . . . . 25.0 112.17 -178.933 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.7 t -72.91 136.17 26.13 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.401 0 C-N-CA 125.646 1.578 . . . . 25.0 108.076 178.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.253 1.259 0 CA-C-O 117.851 -1.071 . . . . 25.0 110.246 179.881 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 50.5 m . . . . . 0 N--CA 1.477 0.922 0 N-CA-C 110.298 -0.26 . . . . 25.0 110.298 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 12.1 t -142.73 154.23 44.07 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 125.209 1.404 . . . . 25.0 110.243 179.876 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 79.7 mt -81.73 169.08 17.38 Favored 'General case' 0 CA--C 1.535 0.374 0 C-N-CA 124.343 1.057 . . . . 25.0 110.056 179.223 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 29.7 m-85 -130.4 146.48 51.97 Favored 'General case' 0 CA--C 1.531 0.232 0 C-N-CA 125.551 1.541 . . . . 25.0 108.408 179.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -123.32 152.31 41.57 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 124.452 1.101 . . . . 25.0 110.937 -179.664 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.15 134.89 37.59 Favored 'General case' 0 CA--C 1.532 0.286 0 C-N-CA 125.824 1.65 . . . . 25.0 112.951 -179.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 91.3 mt -89.6 -29.06 19.11 Favored 'General case' 0 CA--C 1.536 0.406 0 C-N-CA 126.18 1.792 . . . . 25.0 111.909 179.248 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 69.0 m-85 -153.8 162.75 40.97 Favored 'General case' 0 C--N 1.344 0.365 0 C-N-CA 125.752 1.621 . . . . 25.0 110.167 -179.705 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.0 m-20 -61.19 149.26 38.1 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 123.526 0.73 . . . . 25.0 109.93 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.2 t80 -146.79 135.82 22.47 Favored 'General case' 0 C--N 1.338 0.107 0 C-N-CA 123.979 0.912 . . . . 25.0 109.277 178.36 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 37.3 mm-40 -110.08 136.58 49.1 Favored 'General case' 0 C--O 1.233 0.218 0 N-CA-C 107.299 -1.371 . . . . 25.0 107.299 178.283 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -61.52 127.05 29.6 Favored 'General case' 0 C--N 1.342 0.241 0 C-N-CA 123.95 0.9 . . . . 25.0 109.534 179.945 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 61.3 mtp180 -87.71 -22.23 24.74 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.075 0.95 . . . . 25.0 111.698 -178.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 72.3 p -134.08 171.74 13.8 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.583 1.553 . . . . 25.0 110.214 179.334 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -69.03 -17.37 63.89 Favored 'General case' 0 CA--C 1.542 0.66 0 C-N-CA 123.994 0.918 . . . . 25.0 111.903 178.075 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.7 m-20 -96.66 -6.17 37.2 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 125.92 1.688 . . . . 25.0 112.444 -179.663 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 72.2 m-20 -94.83 157.86 15.74 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 124.564 1.146 . . . . 25.0 110.542 -179.367 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 49.9 mt -106.92 139.85 40.66 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.229 1.412 . . . . 25.0 110.856 179.501 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 69.6 m -97.64 143.38 28.37 Favored 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 47.2 p90 -159.31 173.82 15.71 Favored 'General case' 0 C--N 1.343 0.284 0 CA-C-O 121.675 0.75 . . . . 25.0 111.382 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.6 m-70 -124.3 158.98 31.28 Favored 'General case' 0 CA--C 1.532 0.266 0 C-N-CA 125.362 1.465 . . . . 25.0 109.436 178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -54.24 134.31 44.78 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 125.084 1.354 . . . . 25.0 110.849 -179.746 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 94.26 -9.27 72.28 Favored Glycine 0 CA--C 1.535 1.332 0 C-N-CA 125.157 1.361 . . . . 25.0 113.797 179.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.4 tt0 -70.44 135.57 48.81 Favored 'General case' 0 C--N 1.345 0.375 0 CA-C-N 119.038 1.419 . . . . 25.0 109.631 179.721 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.5 mttm -99.75 151.8 20.83 Favored 'General case' 0 C--N 1.342 0.27 0 CA-C-O 121.559 0.695 . . . . 25.0 111.599 -179.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -139.78 157.0 46.45 Favored 'General case' 0 N--CA 1.453 -0.294 0 C-N-CA 125.685 1.594 . . . . 25.0 112.832 -177.825 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -105.9 130.45 53.86 Favored 'General case' 0 N--CA 1.452 -0.337 0 C-N-CA 127.014 2.126 . . . . 25.0 105.439 177.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 43.8 mm -82.94 121.21 35.66 Favored 'Isoleucine or valine' 0 CA--C 1.53 0.178 0 N-CA-C 109.592 -0.521 . . . . 25.0 109.592 -179.011 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 97.5 mt -92.79 -43.16 9.16 Favored 'General case' 0 CA--C 1.534 0.349 0 C-N-CA 123.989 0.915 . . . . 25.0 108.741 178.589 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.95 128.47 6.3 Favored 'General case' 0 C--N 1.347 0.49 0 C-N-CA 124.018 0.927 . . . . 25.0 109.516 178.401 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 82.4 p -125.61 12.4 8.01 Favored 'General case' 0 CA--C 1.538 0.497 0 N-CA-C 115.407 1.632 . . . . 25.0 115.407 -179.372 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 78.1 p -97.44 0.71 48.17 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.995 1.318 . . . . 25.0 114.243 -179.385 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 33.7 mt-10 -88.16 15.98 6.78 Favored 'General case' 0 CA--C 1.538 0.495 0 C-N-CA 125.205 1.402 . . . . 25.0 113.671 -179.951 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.65 -157.89 18.69 Favored Glycine 0 C--N 1.344 1.027 0 N-CA-C 111.255 -0.738 . . . . 25.0 111.255 -178.979 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -68.21 -7.26 28.76 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 124.351 1.06 . . . . 25.0 111.503 178.602 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 65.2 t-105 -103.12 111.64 24.1 Favored 'General case' 0 CA--C 1.534 0.342 0 C-N-CA 126.26 1.824 . . . . 25.0 106.447 178.547 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -111.01 153.17 25.96 Favored 'General case' 0 C--N 1.343 0.304 0 C-N-CA 123.702 0.801 . . . . 25.0 112.736 -178.65 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.8 tt0 -99.09 128.39 45.22 Favored 'General case' 0 N--CA 1.451 -0.404 0 C-N-CA 126.631 1.972 . . . . 25.0 106.178 178.362 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 16.5 m -142.86 169.73 12.03 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.397 0 CA-C-O 122.079 0.942 . . . . 25.0 112.887 -179.19 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 47.4 ttt-85 -124.85 126.9 46.31 Favored 'General case' 0 N--CA 1.449 -0.477 0 C-N-CA 127.247 2.219 . . . . 25.0 108.305 176.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 43.8 t -78.13 121.69 24.64 Favored 'General case' 0 N--CA 1.447 -0.582 0 N-CA-C 107.022 -1.473 . . . . 25.0 107.022 178.562 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 94.2 mt -78.54 -16.66 57.2 Favored 'General case' 0 CA--C 1.539 0.522 0 C-N-CA 123.466 0.706 . . . . 25.0 111.19 178.912 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 85.4 m -88.67 -45.06 10.13 Favored 'General case' 0 CA--C 1.538 0.505 0 C-N-CA 124.777 1.231 . . . . 25.0 111.725 -179.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 10.6 p -95.82 -21.83 17.86 Favored 'General case' 0 N--CA 1.472 0.626 0 N-CA-C 113.336 0.865 . . . . 25.0 113.336 -178.997 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.07 1.04 89.77 Favored Glycine 0 CA--C 1.537 1.441 0 CA-C-O 118.085 -1.397 . . . . 25.0 112.832 -178.864 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 46.6 mm-40 -89.85 164.55 14.57 Favored 'General case' 0 C--N 1.349 0.572 0 CA-C-N 119.342 1.571 . . . . 25.0 111.945 -178.764 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 40.6 p -120.48 147.76 44.71 Favored 'General case' 0 C--N 1.344 0.355 0 C-N-CA 125.071 1.348 . . . . 25.0 111.37 -179.618 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.54 -168.42 38.93 Favored Glycine 0 CA--C 1.529 0.966 0 C-N-CA 124.948 1.261 . . . . 25.0 111.9 179.131 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 73.0 m-85 -115.24 140.52 49.03 Favored 'General case' 0 C--N 1.34 0.16 0 C-N-CA 124.323 1.049 . . . . 25.0 110.299 179.717 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 27.0 pt -143.41 149.1 46.58 Favored Pre-proline 0 CA--C 1.543 0.676 0 C-N-CA 124.657 1.183 . . . . 25.0 109.236 179.299 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.5 Cg_endo -68.7 124.43 11.51 Favored 'Trans proline' 0 CA--C 1.536 0.619 0 C-N-CA 123.867 3.045 . . . . 25.0 111.646 -179.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.6 p -58.08 -35.45 33.95 Favored Pre-proline 0 CA--C 1.549 0.942 0 CA-C-O 115.719 -2.086 . . . . 25.0 116.392 179.112 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.6 Cg_endo -64.31 -18.34 62.88 Favored 'Trans proline' 0 C--N 1.36 1.143 0 CA-C-N 123.394 2.248 . . . . 25.0 114.044 179.066 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.43 -3.63 47.39 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.742 0.817 . . . . 25.0 110.255 178.775 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 28.2 mt -119.78 158.83 25.75 Favored 'General case' 0 C--N 1.345 0.393 0 C-N-CA 125.94 1.696 . . . . 25.0 112.252 -179.403 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.6 136.96 16.94 Favored Pre-proline 0 CA--C 1.537 0.451 0 C-N-CA 127.231 2.213 . . . . 25.0 107.275 177.348 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_endo -64.73 145.85 87.38 Favored 'Trans proline' 0 C--N 1.348 0.544 0 C-N-CA 122.735 2.29 . . . . 25.0 111.83 -179.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.2 t -72.57 135.93 26.71 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 107.466 -1.309 . . . . 25.0 107.466 179.12 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.7 m-20 . . . . . 0 C--O 1.251 1.168 0 C-N-CA 127.369 2.267 . . . . 25.0 109.438 -179.714 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 33.0 t . . . . . 0 N--CA 1.473 0.681 0 CA-C-O 119.327 -0.368 . . . . 25.0 110.098 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 15.3 t -143.66 151.98 40.78 Favored 'General case' 0 CA--C 1.536 0.408 0 C-N-CA 124.94 1.296 . . . . 25.0 110.791 -179.703 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 61.0 mt -82.08 166.2 19.94 Favored 'General case' 0 CA--C 1.534 0.348 0 C-N-CA 124.525 1.13 . . . . 25.0 109.325 178.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.0 m-85 -130.39 148.01 52.16 Favored 'General case' 0 CA--C 1.531 0.228 0 C-N-CA 124.821 1.248 . . . . 25.0 109.154 179.444 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 15.7 pt-20 -126.25 156.07 40.88 Favored 'General case' 0 CA--C 1.533 0.305 0 C-N-CA 124.616 1.166 . . . . 25.0 111.157 -179.672 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -78.81 134.36 36.99 Favored 'General case' 0 CA--C 1.531 0.242 0 C-N-CA 125.394 1.478 . . . . 25.0 112.68 -179.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 80.1 mt -87.77 -29.36 21.09 Favored 'General case' 0 CA--C 1.536 0.43 0 C-N-CA 125.632 1.573 . . . . 25.0 112.143 179.373 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 92.6 m-85 -154.69 165.79 35.45 Favored 'General case' 0 C--N 1.342 0.279 0 C-N-CA 126.099 1.759 . . . . 25.0 109.92 -179.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 62.3 m-20 -61.28 149.18 38.71 Favored 'General case' 0 CA--C 1.536 0.434 0 C-N-CA 123.728 0.811 . . . . 25.0 110.654 176.409 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -149.58 135.92 19.1 Favored 'General case' 0 N--CA 1.456 -0.129 0 C-N-CA 124.543 1.137 . . . . 25.0 109.308 178.804 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 45.4 mm-40 -113.12 137.45 51.42 Favored 'General case' 0 C--O 1.234 0.242 0 N-CA-C 106.411 -1.7 . . . . 25.0 106.411 177.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -58.89 127.66 33.33 Favored 'General case' 0 C--N 1.341 0.207 0 C-N-CA 124.039 0.936 . . . . 25.0 111.019 -178.86 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 40.0 mtp-105 -88.42 -22.93 23.47 Favored 'General case' 0 CA--C 1.535 0.377 0 C-N-CA 125.334 1.453 . . . . 25.0 111.728 -179.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 49.2 p -133.1 170.13 15.84 Favored 'General case' 0 CA--C 1.537 0.46 0 C-N-CA 125.534 1.534 . . . . 25.0 109.814 179.085 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -69.6 -18.6 63.63 Favored 'General case' 0 CA--C 1.542 0.642 0 C-N-CA 123.364 0.666 . . . . 25.0 111.861 178.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.8 m-20 -95.17 -6.55 41.48 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 125.735 1.614 . . . . 25.0 112.096 -179.842 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.6 m-20 -90.66 151.42 21.28 Favored 'General case' 0 C--N 1.344 0.344 0 C-N-CA 123.809 0.843 . . . . 25.0 110.75 -179.316 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 76.3 mt -100.67 134.46 43.59 Favored 'General case' 0 CA--C 1.531 0.249 0 C-N-CA 125.251 1.42 . . . . 25.0 109.222 179.322 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.9 m -91.65 142.78 27.24 Favored 'General case' 0 CA--C 1.531 0.235 0 N-CA-C 106.936 -1.505 . . . . 25.0 106.936 177.73 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 45.0 p90 -154.15 168.04 27.84 Favored 'General case' 0 C--N 1.341 0.209 0 CA-C-O 121.654 0.74 . . . . 25.0 111.845 -179.753 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 86.8 m-70 -125.06 157.81 35.34 Favored 'General case' 0 N--CA 1.454 -0.234 0 C-N-CA 125.175 1.39 . . . . 25.0 108.755 178.863 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 64.1 tttm -54.18 134.15 44.44 Favored 'General case' 0 CA--C 1.537 0.449 0 C-N-CA 124.355 1.062 . . . . 25.0 110.306 -179.441 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.26 -8.87 69.72 Favored Glycine 0 CA--C 1.537 1.424 0 CA-C-O 118.302 -1.277 . . . . 25.0 113.732 -179.877 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 21.0 tt0 -69.93 132.22 45.63 Favored 'General case' 0 C--N 1.346 0.426 0 CA-C-N 119.147 1.474 . . . . 25.0 110.388 179.705 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 65.8 mttm -97.9 152.06 19.61 Favored 'General case' 0 C--N 1.342 0.25 0 C-N-CA 124.025 0.93 . . . . 25.0 110.556 -179.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 94.8 m-85 -140.68 155.4 46.5 Favored 'General case' 0 N--CA 1.454 -0.249 0 C-N-CA 124.736 1.214 . . . . 25.0 112.615 -178.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 31.3 tt0 -106.01 130.19 53.98 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 105.962 -1.866 . . . . 25.0 105.962 177.249 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 47.6 mm -81.16 122.3 36.06 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.24 0 C-N-CA 123.368 0.667 . . . . 25.0 109.962 -178.951 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 64.8 mt -99.58 -44.35 6.17 Favored 'General case' 0 CA--C 1.535 0.371 0 C-N-CA 124.001 0.92 . . . . 25.0 110.06 178.719 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -156.45 128.46 7.39 Favored 'General case' 0 C--N 1.347 0.461 0 C-N-CA 123.702 0.801 . . . . 25.0 110.824 179.381 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 65.7 m -125.7 12.54 7.97 Favored 'General case' 0 CA--C 1.542 0.653 0 C-N-CA 125.057 1.343 . . . . 25.0 113.549 179.642 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 80.2 p -93.38 -2.69 54.42 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.101 0.961 . . . . 25.0 113.525 -179.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 32.0 mt-10 -87.82 15.69 6.75 Favored 'General case' 0 CA--C 1.54 0.577 0 C-N-CA 125.385 1.474 . . . . 25.0 113.415 179.972 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.94 18.63 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 118.526 0.603 . . . . 25.0 111.964 -179.616 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.1 m-20 -67.26 -9.6 42.2 Favored 'General case' 0 CA--C 1.544 0.748 0 C-N-CA 124.902 1.281 . . . . 25.0 111.411 178.772 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 38.8 t-105 -100.01 107.54 19.5 Favored 'General case' 0 N--CA 1.453 -0.317 0 N-CA-C 105.948 -1.871 . . . . 25.0 105.948 178.798 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.3 m0 -105.13 151.78 23.61 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 112.847 0.684 . . . . 25.0 112.847 -178.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 31.0 tt0 -98.67 128.03 44.8 Favored 'General case' 0 N--CA 1.449 -0.494 0 N-CA-C 106.225 -1.769 . . . . 25.0 106.225 177.572 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.6 m -141.62 168.81 14.9 Favored 'Isoleucine or valine' 0 C--O 1.233 0.23 0 C-N-CA 123.574 0.75 . . . . 25.0 111.085 -179.739 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 38.3 ttt-85 -117.73 123.77 46.84 Favored 'General case' 0 N--CA 1.449 -0.522 0 N-CA-C 106.875 -1.528 . . . . 25.0 106.875 177.023 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 45.5 t -75.62 116.39 16.29 Favored 'General case' 0 N--CA 1.446 -0.649 0 N-CA-C 105.941 -1.874 . . . . 25.0 105.941 178.657 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.5 mt -77.66 -16.88 58.22 Favored 'General case' 0 CA--C 1.539 0.529 0 C-N-CA 123.825 0.85 . . . . 25.0 111.536 -179.782 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 53.5 m -87.87 -46.69 9.2 Favored 'General case' 0 CA--C 1.537 0.469 0 C-N-CA 124.748 1.219 . . . . 25.0 111.826 179.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 16.8 p -93.5 -20.71 20.01 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 113.45 0.907 . . . . 25.0 113.45 -178.595 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 81.26 4.38 90.48 Favored Glycine 0 CA--C 1.538 1.489 0 CA-C-O 118.471 -1.183 . . . . 25.0 112.254 -178.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 50.7 mm-40 -89.89 167.15 13.05 Favored 'General case' 0 C--N 1.348 0.519 0 CA-C-N 119.016 1.408 . . . . 25.0 111.688 -178.968 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 27.4 p -121.76 145.12 48.36 Favored 'General case' 0 CA--C 1.534 0.334 0 C-N-CA 125.297 1.439 . . . . 25.0 109.125 178.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.68 -168.31 38.68 Favored Glycine 0 CA--C 1.528 0.862 0 C-N-CA 123.85 0.738 . . . . 25.0 112.633 -179.857 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 69.4 m-85 -120.16 141.41 49.89 Favored 'General case' 0 CA--C 1.528 0.12 0 C-N-CA 124.874 1.27 . . . . 25.0 111.032 -179.104 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 35.7 pt -146.41 152.86 47.02 Favored Pre-proline 0 CA--C 1.538 0.516 0 C-N-CA 124.914 1.285 . . . . 25.0 110.087 179.191 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 51.0 Cg_endo -68.51 123.47 10.54 Favored 'Trans proline' 0 N--CA 1.457 -0.649 0 C-N-CA 123.435 2.756 . . . . 25.0 111.303 179.976 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.1 p -58.24 -35.7 36.27 Favored Pre-proline 0 CA--C 1.548 0.89 0 CA-C-O 115.921 -1.99 . . . . 25.0 116.235 178.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.7 Cg_endo -64.37 -18.43 63.09 Favored 'Trans proline' 0 C--N 1.361 1.208 0 CA-C-N 123.184 2.173 . . . . 25.0 114.432 179.542 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.6 m-85 -79.15 -3.6 46.36 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 119.003 0.82 . . . . 25.0 110.702 179.183 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.6 mt -118.83 158.43 25.66 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.813 1.645 . . . . 25.0 111.881 -179.063 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -136.29 138.13 26.3 Favored Pre-proline 0 CA--C 1.537 0.449 0 C-N-CA 127.036 2.134 . . . . 25.0 108.295 178.423 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 53.0 Cg_endo -67.71 141.24 53.94 Favored 'Trans proline' 0 C--N 1.348 0.548 0 C-N-CA 122.731 2.287 . . . . 25.0 111.913 -179.124 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 84.4 t -72.75 135.89 26.76 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.365 0 N-CA-C 107.288 -1.375 . . . . 25.0 107.288 178.459 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.25 1.131 0 C-N-CA 126.124 1.77 . . . . 25.0 110.352 179.89 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' SER . . . . . . . . . . . . . 69.6 m . . . . . 0 N--CA 1.474 0.75 0 CA-C-O 119.046 -0.502 . . . . 25.0 109.887 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' THR . . . . . . . . . . . . . 7.6 t -147.49 156.43 42.84 Favored 'General case' 0 CA--C 1.534 0.352 0 C-N-CA 124.978 1.311 . . . . 25.0 110.814 -179.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' LEU . . . . . . . . . . . . . 86.8 mt -82.23 157.37 23.95 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.151 0.981 . . . . 25.0 108.824 178.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' PHE . . . . . . . . . . . . . 30.6 m-85 -130.38 148.99 52.26 Favored 'General case' 0 CA--C 1.533 0.312 0 C-N-CA 124.734 1.214 . . . . 25.0 109.924 -179.635 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' GLU . . . . . . . . . . . . . 11.7 pt-20 -122.12 155.53 35.53 Favored 'General case' 0 CA--C 1.534 0.332 0 C-N-CA 125.156 1.382 . . . . 25.0 110.127 179.25 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -80.88 130.78 35.22 Favored 'General case' 0 N--CA 1.456 -0.173 0 C-N-CA 124.872 1.269 . . . . 25.0 112.697 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LEU . . . . . . . . . . . . . 95.2 mt -89.34 -30.12 18.64 Favored 'General case' 0 CA--C 1.534 0.351 0 C-N-CA 125.644 1.578 . . . . 25.0 111.293 178.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' TYR . . . . . . . . . . . . . 8.8 m-85 -148.45 157.11 43.26 Favored 'General case' 0 C--N 1.344 0.33 0 C-N-CA 125.39 1.476 . . . . 25.0 110.152 -178.86 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ASP . . . . . . . . . . . . . 61.5 m-20 -61.04 149.27 37.49 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.27 0.628 . . . . 25.0 110.288 176.147 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' TYR . . . . . . . . . . . . . 84.8 t80 -144.3 137.31 27.11 Favored 'General case' 0 C--N 1.34 0.159 0 C-N-CA 124.72 1.208 . . . . 25.0 110.149 178.471 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' GLU . . . . . . . . . . . . . 40.4 mm-40 -114.56 135.31 54.26 Favored 'General case' 0 C--O 1.233 0.232 0 N-CA-C 106.995 -1.484 . . . . 25.0 106.995 178.101 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -60.82 128.96 39.1 Favored 'General case' 0 C--N 1.342 0.239 0 C-N-CA 124.324 1.05 . . . . 25.0 111.314 -179.029 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ARG . . . . . . . . . . . . . 36.3 mtp180 -83.87 -29.01 27.56 Favored 'General case' 0 CA--C 1.533 0.293 0 C-N-CA 125.419 1.488 . . . . 25.0 112.038 -179.699 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' THR . . . . . . . . . . . . . 69.3 p -132.12 171.66 13.36 Favored 'General case' 0 CA--C 1.535 0.38 0 C-N-CA 125.205 1.402 . . . . 25.0 110.542 179.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLU . . . . . . . . . . . . . 8.6 pt-20 -68.75 -17.21 64.01 Favored 'General case' 0 CA--C 1.542 0.651 0 C-N-CA 124.019 0.927 . . . . 25.0 111.833 178.022 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ASP . . . . . . . . . . . . . 64.9 m-20 -95.08 -5.13 45.0 Favored 'General case' 0 CA--C 1.539 0.55 0 C-N-CA 126.149 1.78 . . . . 25.0 112.301 -179.687 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' ASP . . . . . . . . . . . . . 71.3 m-20 -97.31 156.56 16.39 Favored 'General case' 0 C--N 1.345 0.381 0 C-N-CA 124.272 1.029 . . . . 25.0 111.479 -178.697 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' LEU . . . . . . . . . . . . . 72.3 mt -104.44 136.76 43.41 Favored 'General case' 0 C--N 1.342 0.277 0 C-N-CA 125.562 1.545 . . . . 25.0 110.659 179.659 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' SER . . . . . . . . . . . . . 66.6 m -95.02 145.47 24.93 Favored 'General case' 0 C--O 1.235 0.316 0 N-CA-C 107.469 -1.308 . . . . 25.0 107.469 177.422 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' PHE . . . . . . . . . . . . . 46.8 p90 -154.67 169.53 23.67 Favored 'General case' 0 C--N 1.342 0.252 0 CA-C-O 121.822 0.82 . . . . 25.0 111.636 179.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' HIS . . . . . . . . . . . . . 74.9 m-70 -125.43 158.43 34.41 Favored 'General case' 0 N--CA 1.454 -0.264 0 C-N-CA 125.392 1.477 . . . . 25.0 108.932 178.757 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -54.3 134.21 45.08 Favored 'General case' 0 CA--C 1.538 0.499 0 C-N-CA 124.763 1.225 . . . . 25.0 110.0 179.518 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' GLY . . . . . . . . . . . . . . . 95.59 -11.52 68.37 Favored Glycine 0 CA--C 1.537 1.414 0 C-N-CA 125.06 1.314 . . . . 25.0 113.552 -179.534 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' GLU . . . . . . . . . . . . . 20.8 tt0 -70.83 134.16 47.11 Favored 'General case' 0 C--N 1.347 0.459 0 CA-C-N 119.194 1.497 . . . . 25.0 110.032 179.546 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 67.1 mttm -100.95 154.02 19.03 Favored 'General case' 0 C--N 1.342 0.266 0 C-N-CA 123.562 0.745 . . . . 25.0 111.243 -179.212 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' PHE . . . . . . . . . . . . . 95.6 m-85 -140.39 154.93 46.88 Favored 'General case' 0 N--CA 1.453 -0.321 0 C-N-CA 124.956 1.302 . . . . 25.0 113.737 -177.567 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' GLN . . . . . . . . . . . . . 57.5 tt0 -107.11 129.23 54.86 Favored 'General case' 0 N--CA 1.454 -0.27 0 N-CA-C 104.049 -2.575 . . . . 25.0 104.049 175.533 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ILE . . . . . . . . . . . . . 37.7 mm -81.36 121.11 34.26 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.218 0 C-N-CA 123.197 0.599 . . . . 25.0 109.913 -178.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' LEU . . . . . . . . . . . . . 96.8 mt -93.04 -42.5 9.39 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 124.229 1.012 . . . . 25.0 109.205 178.941 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ASN . . . . . . . . . . . . . 1.4 t30 -157.06 126.87 6.22 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 123.985 0.914 . . . . 25.0 109.913 178.522 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' SER . . . . . . . . . . . . . 80.4 p -125.74 12.4 7.93 Favored 'General case' 0 CA--C 1.537 0.472 0 N-CA-C 114.797 1.406 . . . . 25.0 114.797 -179.939 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' SER . . . . . . . . . . . . . 81.0 p -96.47 -2.16 45.88 Favored 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 125.246 1.419 . . . . 25.0 114.391 -179.102 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' GLU . . . . . . . . . . . . . 35.2 mt-10 -88.53 16.31 6.75 Favored 'General case' 0 CA--C 1.538 0.506 0 C-N-CA 125.13 1.372 . . . . 25.0 113.952 -179.99 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' GLY . . . . . . . . . . . . . . . 101.73 -157.95 18.63 Favored Glycine 0 C--N 1.345 1.077 0 CA-C-N 118.75 0.705 . . . . 25.0 112.831 179.958 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ASP . . . . . . . . . . . . . 79.0 m-20 -67.86 -0.21 4.02 Favored 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 125.734 1.614 . . . . 25.0 112.071 179.216 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 48.6 t-105 -115.92 112.21 21.55 Favored 'General case' 0 CA--C 1.535 0.396 0 C-N-CA 126.834 2.053 . . . . 25.0 106.166 178.836 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' TRP . . . . . . . . . . . . . 52.1 m0 -110.11 154.12 23.74 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 124.013 0.925 . . . . 25.0 113.069 -178.335 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 -98.43 127.43 44.36 Favored 'General case' 0 N--CA 1.451 -0.425 0 N-CA-C 105.426 -2.065 . . . . 25.0 105.426 177.228 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' VAL . . . . . . . . . . . . . 18.8 m -141.09 168.78 15.69 Favored 'Isoleucine or valine' 0 C--O 1.233 0.191 0 CA-C-O 121.715 0.769 . . . . 25.0 111.694 -179.294 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' ARG . . . . . . . . . . . . . 16.6 ttt85 -121.42 123.2 41.51 Favored 'General case' 0 N--CA 1.448 -0.531 0 C-N-CA 125.565 1.546 . . . . 25.0 107.913 177.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' SER . . . . . . . . . . . . . 31.4 t -74.42 118.34 17.27 Favored 'General case' 0 N--CA 1.448 -0.531 0 N-CA-C 105.174 -2.158 . . . . 25.0 105.174 178.106 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LEU . . . . . . . . . . . . . 97.8 mt -76.45 -12.45 60.05 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.521 0.728 . . . . 25.0 112.086 -179.742 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' THR . . . . . . . . . . . . . 62.0 m -88.62 -43.83 11.07 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.897 1.279 . . . . 25.0 111.567 179.459 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' THR . . . . . . . . . . . . . 20.6 p -98.93 -21.05 16.46 Favored 'General case' 0 N--CA 1.469 0.505 0 N-CA-C 113.987 1.106 . . . . 25.0 113.987 -178.415 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLY . . . . . . . . . . . . . . . 80.14 3.4 89.6 Favored Glycine 0 CA--C 1.538 1.514 0 CA-C-O 118.454 -1.192 . . . . 25.0 112.441 -178.55 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' GLU . . . . . . . . . . . . . 39.1 mm-40 -85.71 161.48 19.18 Favored 'General case' 0 C--N 1.348 0.5 0 CA-C-N 119.051 1.425 . . . . 25.0 111.354 -178.758 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' THR . . . . . . . . . . . . . 46.0 p -120.6 145.32 47.5 Favored 'General case' 0 CA--C 1.534 0.359 0 C-N-CA 124.873 1.269 . . . . 25.0 110.623 -179.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' GLY . . . . . . . . . . . . . . . 179.53 -168.25 38.67 Favored Glycine 0 CA--C 1.529 0.911 0 C-N-CA 124.541 1.067 . . . . 25.0 112.383 179.67 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' TYR . . . . . . . . . . . . . 64.3 m-85 -113.98 149.24 35.61 Favored 'General case' 0 CA--C 1.529 0.148 0 C-N-CA 125.208 1.403 . . . . 25.0 111.746 179.9 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ILE . . . . . . . . . . . . . 30.0 pt -150.04 157.69 37.43 Favored Pre-proline 0 CA--C 1.54 0.593 0 C-N-CA 125.253 1.421 . . . . 25.0 111.003 -179.406 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' PRO . . . . . . . . . . . . . 50.9 Cg_endo -71.26 122.13 8.42 Favored 'Trans proline' 0 N--CA 1.456 -0.725 0 C-N-CA 122.978 2.452 . . . . 25.0 108.593 176.578 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 41.4 p -58.39 -35.19 30.59 Favored Pre-proline 0 CA--C 1.55 0.95 0 N-CA-C 116.953 2.205 . . . . 25.0 116.953 179.227 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' PRO . . . . . . . . . . . . . 52.8 Cg_endo -63.85 -16.21 53.51 Favored 'Trans proline' 0 C--N 1.36 1.184 0 C-N-CA 122.755 2.303 . . . . 25.0 115.199 -179.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' TYR . . . . . . . . . . . . . 10.3 m-85 -77.83 -5.21 50.1 Favored 'General case' 0 CA--C 1.543 0.691 0 CA-C-N 119.332 0.969 . . . . 25.0 111.817 -179.82 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 33.0 mt -119.33 158.46 26.05 Favored 'General case' 0 C--N 1.347 0.465 0 C-N-CA 124.515 1.126 . . . . 25.0 112.274 -179.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' ALA . . . . . . . . . . . . . . . -140.25 143.26 32.84 Favored Pre-proline 0 CA--C 1.537 0.467 0 C-N-CA 127.596 2.358 . . . . 25.0 108.428 178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' PRO . . . . . . . . . . . . . 51.4 Cg_endo -62.44 146.59 95.6 Favored 'Trans proline' 0 CA--C 1.536 0.601 0 C-N-CA 122.809 2.34 . . . . 25.0 111.272 -179.617 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' VAL . . . . . . . . . . . . . 90.9 t -72.46 135.85 26.89 Favored 'Isoleucine or valine' 0 CA--C 1.532 0.264 0 C-N-CA 123.971 0.909 . . . . 25.0 109.919 -178.891 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' ASP . . . . . . . . . . . . . 87.8 m-20 . . . . . 0 C--O 1.25 1.124 0 C-N-CA 127.174 2.189 . . . . 25.0 110.604 179.582 . . . . . . . . 0 0 . 1 stop_ save_